Product Name

  • Name

    Ethyl acetate

  • EINECS 205-500-4
  • CAS No. 141-78-6
  • Article Data1071
  • CAS DataBase
  • Density 0.898 g/cm3
  • Solubility 8.3 g/100 mL (20 °C) in water, miscible with ethanol, acetone, diethyl ether, benzene
  • Melting Point -83.6 °C, 190 K, -118 °F
  • Formula C4H8O2
  • Boiling Point 77.1 °C, 350 K, 171 °F
  • Molecular Weight 88.1063
  • Flash Point -4 °C
  • Transport Information UN 1173 3/PG 2
  • Appearance colorless liquid
  • Safety 16-26-33
  • Risk Codes 11-36-66-67
  • Molecular Structure Molecular Structure of 141-78-6 (Ethyl acetate)
  • Hazard Symbols FlammableF,IrritantXi
  • Synonyms Ethyl ethanoate;Ethyl ester;Acetic ester;Ester of ethanol;AI3-00404;Acetate d'ethyle;Acetic acid, ethyl ester;Acetidin;Acetoxyethane;Aethylacetat;
  • PSA 26.30000
  • LogP 0.56940

Synthetic route

ethanol
64-17-5

ethanol

2,4-dinitrophenyl acetate
4232-27-3

2,4-dinitrophenyl acetate

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With [{lμ2-3-1κO-((carboxylatomethyl)amino)-4-chlorobenzoato}(N,N,N-κ3-2,3,5,6-tetrakis(2-pyridyl)pyrazine)zinc(II)]n(dimethylformamide)(water) In dimethyl sulfoxide at 80℃; for 5h; Time;85%
ethanol
64-17-5

ethanol

acetic acid
64-19-7

acetic acid

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
niobium(V) oxide at 200℃; for 1h; Product distribution; examination of niobic acid as an efficient catalyst; var. catalysts, temps;;100%
With sulfuric acid at 70℃; for 5h; Reagent/catalyst;96%
With 1-butyl-2-methylbenzimidazolium tetrafluoroborate at 80℃; for 2h;95%
ethanol
64-17-5

ethanol

A

acetaldehyde
75-07-0

acetaldehyde

B

acetic acid
64-19-7

acetic acid

C

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With oxygen; Pd on Zeolite Y at 90 - 110℃; under 760.051 - 1520.1 Torr; Product distribution / selectivity;A 0.5%
B 7.5%
C 49.6%
With oxygen; Pd on Zeolite Y In water at 70 - 150℃; under 22801.5 Torr; Conversion of starting material;A 0.1%
B 3.6%
C 22.5%
With oxygen; Pt on Zeolite ZSM-5 at 110℃; under 1520.1 Torr; Product distribution / selectivity;A 7.4%
B 3.9%
C 10.2%
ethanol
64-17-5

ethanol

A

acetaldehyde
75-07-0

acetaldehyde

B

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With copper supported on ZnAl2O4 at 399.84℃; Temperature; Flow reactor;A 90%
B n/a
With oxygen; Sb2O4-MoO3 (Sb4Mo10O31) at 200 - 350℃; in a flow system;A n/a
B 30%
With oxygen; Sb2O4-MoO3 (Sb4Mo10O31) at 200 - 350℃; Product distribution; selectivity and activity of the Sb-Mo-O catalyst in the oxidation of ethanol;A n/a
B 30%
diethyl sulfate
64-67-5

diethyl sulfate

ethylene glycol
107-21-1

ethylene glycol

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With lithium hydroxide at 35℃; under 50 Torr; Temperature; Pressure; Reagent/catalyst;62%
acetaldehyde
75-07-0

acetaldehyde

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With [{(PhN)MeC(Nt-Bu)}AlMe(μ-OMe)]2 at 20℃; for 16h; Tishchenko-Claisen Dismutation; Inert atmosphere; Schlenk technique; Green chemistry;95%
With Rh(PhBP3)(H)2(NCMe); hydrogen In toluene at 20℃; under 760.051 Torr; for 0.166667h; Tishchenko reaction;68%
With magnesium oxide; copper at 400℃;
ethene
74-85-1

ethene

acetic acid
64-19-7

acetic acid

A

diethyl ether
60-29-7

diethyl ether

B

ethanol
64-17-5

ethanol

C

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
Stage #1: acetic acid With water at 92.4℃;
Stage #2: ethene; cesium nitrate; tungstophosphoric acid; water; mixture of, dried, tabletted at 92.4 - 194.4℃; under 6750.68 Torr; Product distribution / selectivity; Gas phase;
A 3.2%
B 3.6%
C 92.7%
With water; cesium nitrate; tungstophosphoric acid; water; mixture of, dried, tabletted at 92.4 - 165℃; under 6750.68 Torr; Product distribution / selectivity; Gas phase;A 3%
B 3.4%
C 91.5%
With water; lithium nitrate; silica; tungstophosphoric acid; water; mixture of, heated at 150 C at 102.2 - 165℃; under 6750.68 Torr; Product distribution / selectivity; Gas phase;A 2.2%
B 5%
C 90.1%
With water; lithium nitrate; silica; tungstosilicic acid; water; mixture of, heated at 150 C at 102.2 - 165℃; under 6750.68 Torr; Conversion of starting material; Gas phase;A 4.7%
B 7.6%
C 87.7%
4-(3-(3,4-dimethylcyclopenta-1,3-dienone)-4-(cyclohexylamino)benzyl)-2-(3,4-dimethylcyclopenta-1,3-dienone)-N-cyclohexylbenzeneamine
943406-22-2

4-(3-(3,4-dimethylcyclopenta-1,3-dienone)-4-(cyclohexylamino)benzyl)-2-(3,4-dimethylcyclopenta-1,3-dienone)-N-cyclohexylbenzeneamine

A

4-(3-(2,3,5-trimethylcyclopenta-1,3-diene)-4-(cyclohexylamino)benzyl)-2-(2,3,5,-trimethylcyclopenta-1,3-diene)-N-cyclohexylbenzeneamine

4-(3-(2,3,5-trimethylcyclopenta-1,3-diene)-4-(cyclohexylamino)benzyl)-2-(2,3,5,-trimethylcyclopenta-1,3-diene)-N-cyclohexylbenzeneamine

B

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With methyllithium; CeCl3 In tetrahydrofuran; diethyl etherA 46%
B n/a
ethanol
64-17-5

ethanol

acetic anhydride
108-24-7

acetic anhydride

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With silver trifluoromethanesulfonate at 60℃; for 0.0666667h; neat (no solvent);97%
With tetrakis(triphenylphosphineoxide)dioxouranium(VI) perchlorate In dichloromethane-d2 at 22℃; for 2h; Mechanism; Reagent/catalyst; Solvent;97%
With vanadyl sulfate trihydrate at 20℃; for 8h;93%
ethanol
64-17-5

ethanol

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With water; potassium iodide at 20℃; for 3h; Electrochemical reaction; Green chemistry;95.2%
With HCl(CO)Ru(Phen-(tBu)PNN); potassium tert-butylate In neat (no solvent) for 14h; Schlenk technique; Inert atmosphere;59%
With iodine; hexachloroplatinate(II) In water47%
acetic acid
64-19-7

acetic acid

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With 0.08%-SO3H functionalized-benzylated Al-SBA-15 nanoporous catalyst at 79.84℃; for 2h;90%
With Ru4H4(CO)8(PBu3)4; hydrogen under 98800 Torr; for 48h; Heating;40.7%
ethene
74-85-1

ethene

acetic acid
64-19-7

acetic acid

A

Heavy Ends

Heavy Ends

B

Light Ends & Permanent Gases

Light Ends & Permanent Gases

C

diethyl ether
60-29-7

diethyl ether

D

ethanol
64-17-5

ethanol

E

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With water; silicotungstic acid / SiO2 at 175℃; under 9000.9 Torr; Gas phase; Industry scale;
With water; silicotungstic acid / SiO2 at 175℃; under 9000.9 Torr; Gas phase; Industry scale;
ethanol
64-17-5

ethanol

A

methane
34557-54-5

methane

B

carbon dioxide
124-38-9

carbon dioxide

C

acetaldehyde
75-07-0

acetaldehyde

D

acetic acid
64-19-7

acetic acid

E

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With oxygen at 140℃; for 15h; Reagent/catalyst; Temperature; Inert atmosphere; Autoclave;A n/a
B n/a
C n/a
D 71%
E n/a
acetaldehyde
75-07-0

acetaldehyde

butan-1-ol
71-36-3

butan-1-ol

A

acetic acid butyl ester
123-86-4

acetic acid butyl ester

B

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With 1-hydroxytetraphenylcyclopentadienyl(tetraphenyl-2,4-cyclopentadien-1-one)-μ-hydrotetracarbonyldiruthenium(II) In toluene at 80℃; under 11103.3 Torr; for 1h; Temperature; Inert atmosphere; Autoclave;
2-methyl-propan-1-ol
78-83-1

2-methyl-propan-1-ol

acetaldehyde
75-07-0

acetaldehyde

A

N-isobutylacetamide
1540-94-9

N-isobutylacetamide

B

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With 1-hydroxytetraphenylcyclopentadienyl(tetraphenyl-2,4-cyclopentadien-1-one)-μ-hydrotetracarbonyldiruthenium(II) In toluene at 80℃; under 11103.3 Torr; for 1h; Inert atmosphere; Autoclave;
ethene
74-85-1

ethene

acetic acid
64-19-7

acetic acid

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With water at 179.84℃; under 7500.75 Torr; Inert atmosphere; Gas phase;67%
With sulfuric acid
With pumice stone; water at 450℃; under 14710.2 Torr;
acetic acid
64-19-7

acetic acid

A

ethanol
64-17-5

ethanol

B

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With hydrogen at 270℃; under 19502 Torr; for 1h; Catalytic behavior; Reagent/catalyst;A 90%
B 9%
With hydrogen Reagent/catalyst;A 75%
B n/a
With hydrogen Reagent/catalyst;A 71%
B n/a
2-{4-(4-(6-chloronicotinoyl)benzyl]-3,5-dichlorophenyl}-1,2,4-triazine-3,5(2H,4H)-dione

2-{4-(4-(6-chloronicotinoyl)benzyl]-3,5-dichlorophenyl}-1,2,4-triazine-3,5(2H,4H)-dione

A

2-{4-[4-((6-chloro-pyridin-3-yl)hydroxymethyl)benzyl]-3,5-dichlorophenyl}-1,2,4-triazine-3,5(2H,4H)-dione

2-{4-[4-((6-chloro-pyridin-3-yl)hydroxymethyl)benzyl]-3,5-dichlorophenyl}-1,2,4-triazine-3,5(2H,4H)-dione

B

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With hydrogenchloride; sodium borohydrid In methanol; waterA 66.4%
B n/a
acetic acid
64-19-7

acetic acid

A

carbon dioxide
124-38-9

carbon dioxide

B

ethyl acetate
141-78-6

ethyl acetate

C

acetone
67-64-1

acetone

Conditions
ConditionsYield
With hydrogen at 240 - 280℃; under 15751.6 Torr; Reagent/catalyst; Flow reactor;
ethanol
64-17-5

ethanol

A

acetaldehyde
75-07-0

acetaldehyde

B

ethyl acetate
141-78-6

ethyl acetate

C

crotonaldehyde
123-73-9

crotonaldehyde

Conditions
ConditionsYield
With 5Cu/ZrO2 at 224.84℃; under 760.051 Torr; Reagent/catalyst;
butanoic acid ethyl ester
105-54-4

butanoic acid ethyl ester

A

ethanol
64-17-5

ethanol

B

butyl butyrate
109-21-7

butyl butyrate

C

ethyl acetate
141-78-6

ethyl acetate

D

butan-1-ol
71-36-3

butan-1-ol

Conditions
ConditionsYield
With C21H35BrMnN2O2P; hydrogen; potassium hydride In toluene at 100℃; under 15001.5 Torr; for 22h;A 35 %Spectr.
B 12 %Spectr.
C 11 %Spectr.
D 32 %Spectr.
acetic acid methyl ester
79-20-9

acetic acid methyl ester

A

methanol
67-56-1

methanol

B

ethanol
64-17-5

ethanol

C

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With (K(1+))2<(Ph3P)3(Ph2P)Ru2H4>(2-)*2C6H14O3; hydrogen In toluene under 4650.4 Torr; 1) 23 deg C, 0.5 h; 2) 90 deg C, 20 h;
With hydrogen; <(Ph3P)(Ph2P)RuH2-K+*diglyme>2 In toluene at 90℃; under 4650.4 Torr; for 20h; Title compound not separated from byproducts;
With (K(1+))2<(Ph3P)3(Ph2P)Ru2H4>(2-)*2C6H14O3; hydrogen In toluene under 4650.4 Torr; Product distribution; further carboxylic acid esters; other reagents; 1) 23 deg C, 0.5 h; 2) 90 deg C, 20 h;;
carbon monoxide
201230-82-2

carbon monoxide

acetic acid
64-19-7

acetic acid

A

methanol
67-56-1

methanol

B

ethanol
64-17-5

ethanol

C

acetic acid methyl ester
79-20-9

acetic acid methyl ester

D

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With hydrogen; Cu/ZnO/Al2O3 catalyst (MK-121) at 260℃; under 34375.6 Torr;
acetic acid
64-19-7

acetic acid

A

diethyl ether
60-29-7

diethyl ether

B

ethanol
64-17-5

ethanol

C

acetaldehyde
75-07-0

acetaldehyde

D

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With hydrogen at 240 - 280℃; under 15751.6 Torr; Reagent/catalyst; Flow reactor;
acetic acid
64-19-7

acetic acid

formic acid ethyl ester
109-94-4

formic acid ethyl ester

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With styrene macroporous cation exchange resin In toluene at 50℃; for 3h;
With styrene-based macroporous cation exchange resin In toluene at 50℃; for 3h; Green chemistry;
vinyl acetate
108-05-4

vinyl acetate

carbon monoxide
201230-82-2

carbon monoxide

A

2-acetoxypropanal
22094-23-1

2-acetoxypropanal

B

3-acetoxypropanal
18545-28-3

3-acetoxypropanal

C

acetic acid
64-19-7

acetic acid

D

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With hydrogen; dicobalt octacarbonyl In toluene at 120℃; under 72402.6 - 77574.3 Torr; for 1.83333 - 2h; Product distribution / selectivity;
With hydrogen; dicobalt octacarbonyl In dichloromethane at 120℃; under 77574.3 Torr; for 1h; Product distribution / selectivity;
With hydrogen; dicobalt octacarbonyl In pyridine at 120℃; under 31029.7 Torr; for 1h; Product distribution / selectivity;
With hydrogen; dicobalt octacarbonyl In dichlorobenzene, 1,2- at 120℃; under 77574.3 Torr; for 1h; Product distribution / selectivity;
Stage #1: carbon monoxide With hydrogen; cobalt(II) acetate In toluene at 200℃; under 51716.2 - 103432 Torr; for 0.75h;
Stage #2: vinyl acetate In toluene at 120℃; under 93089.1 Torr; Product distribution / selectivity;
vinyl acetate
108-05-4

vinyl acetate

A

ethanol
64-17-5

ethanol

B

acetic acid butyl ester
123-86-4

acetic acid butyl ester

C

ethyl acetate
141-78-6

ethyl acetate

D

acetone
67-64-1

acetone

Conditions
ConditionsYield
With hydrogen; p-benzoquinone; Grace Raney 4310 w/ Mo In Isopropyl acetate at 50 - 89℃; under 6190.25 - 11310.2 Torr; for 0.1 - 1.68333h; Product distribution / selectivity;
With hydrogen; p-benzoquinone; Grace Raney 4310 w/ Mo at 44.1 - 51℃; under 5983.38 - 10999.9 Torr; for 0.433333 - 1.5h; Product distribution / selectivity;
With hydrogen; p-benzoquinone; 5%-palladium/activated carbon In Isopropyl acetate at 36 - 50℃; under 2311.54 - 6138.53 Torr; for 0.0666667h; Product distribution / selectivity;
With hydrogen; p-benzoquinone; 5%-palladium/activated carbon at 54.25 - 59℃; under 6086.82 - 8827.77 Torr; for 0.266667h; Product distribution / selectivity;
Triisopropyl borate
5419-55-6

Triisopropyl borate

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With hydrogenchloride; n-butyllithium In tetrahydrofuran; hexane41%
methanol
67-56-1

methanol

carbon monoxide
201230-82-2

carbon monoxide

methyl iodide
74-88-4

methyl iodide

A

1,1-dimethoxyethane
534-15-6

1,1-dimethoxyethane

B

ethanol
64-17-5

ethanol

C

acetic acid methyl ester
79-20-9

acetic acid methyl ester

D

acetaldehyde
75-07-0

acetaldehyde

E

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With (acetylacetonato)dicarbonylrhodium (l); hydrogen In toluene at 170℃; under 16276.6 - 25375 Torr; for 4h; Autoclave;
With (acetylacetonato)dicarbonylrhodium (l); rhodium(III) chloride hydrate; 1,3-bis-(diphenylphosphino)propane; hydrogen In toluene at 170℃; under 31015.6 - 47307.2 Torr; for 4h; Concentration; Autoclave;
methanol
67-56-1

methanol

carbon monoxide
201230-82-2

carbon monoxide

methyl iodide
74-88-4

methyl iodide

A

1,1-dimethoxyethane
534-15-6

1,1-dimethoxyethane

B

acetic acid methyl ester
79-20-9

acetic acid methyl ester

C

acetaldehyde
75-07-0

acetaldehyde

D

ethyl acetate
141-78-6

ethyl acetate

Conditions
ConditionsYield
With (acetylacetonato)dicarbonylrhodium (l); 1,3-bis-(diphenylphosphino)propane; hydrogen In toluene at 170℃; under 16276.6 - 25375 Torr; for 4h; Autoclave;
ethyl acetate
141-78-6

ethyl acetate

phenylacetylene
536-74-3

phenylacetylene

4-phenyl-3-butyne-2-one
1817-57-8

4-phenyl-3-butyne-2-one

Conditions
ConditionsYield
Stage #1: phenylacetylene With n-butyllithium In tetrahydrofuran; hexane at -78℃; for 1h;
Stage #2: ethyl acetate With boron trifluoride diethyl etherate In tetrahydrofuran; hexane at -78℃;
100%
Stage #1: phenylacetylene With n-butyllithium In tetrahydrofuran; hexane at 0℃; for 0.5h; Inert atmosphere;
Stage #2: ethyl acetate With boron trifluoride diethyl etherate In tetrahydrofuran; hexane at -78℃; for 0.5h; Inert atmosphere;
Stage #3: With water; ammonium chloride In tetrahydrofuran; hexane at -78 - 20℃;
96%
Stage #1: phenylacetylene With n-butyllithium In tetrahydrofuran; hexane at -78℃; for 0.5h; Schlenk technique;
Stage #2: ethyl acetate With boron trifluoride diethyl etherate In tetrahydrofuran at -78 - 20℃; for 1h;
89%
ethyl acetate
141-78-6

ethyl acetate

acetone
67-64-1

acetone

ethyl 3-hydroxy-3-methylbutanoate
18267-36-2

ethyl 3-hydroxy-3-methylbutanoate

Conditions
ConditionsYield
Stage #1: ethyl acetate With lithium hexamethyldisilazane In tetrahydrofuran at -78℃; for 1h;
Stage #2: acetone In tetrahydrofuran at -78℃; for 0.5h;
100%
Stage #1: ethyl acetate With lithium hexamethyldisilazane In tetrahydrofuran at 20℃; for 1h;
Stage #2: acetone In tetrahydrofuran for 0.5h;
100%
Stage #1: ethyl acetate With lithium hexamethyldisilazane In tetrahydrofuran at -78℃; for 0.5h; Inert atmosphere;
Stage #2: acetone In tetrahydrofuran for 0.166667h;
88%
methanol
67-56-1

methanol

ethyl acetate
141-78-6

ethyl acetate

acetic acid methyl ester
79-20-9

acetic acid methyl ester

Conditions
ConditionsYield
With dilithium tetra(tert-butyl)zincate at 0℃; for 1h; Temperature; Inert atmosphere;100%
K2CO3 + 5percent Carbowax 6000 at 170℃; Product distribution; various catalysts, various amounts of catalysts;54 % Chromat.
With trans-5,15-bis(2-hydroxy-1-naphthyl)octaethylporphyrine; silver perchlorate In benzene at 50℃; without AgClO4, other catalysts;
pentan-1-ol
71-41-0

pentan-1-ol

ethyl acetate
141-78-6

ethyl acetate

1-pentyl acetate
628-63-7

1-pentyl acetate

Conditions
ConditionsYield
zirconium(IV) oxide at 200℃; in vapor-phase;100%
With K5 for 2h; Heating;90%
18-crown-6 ether; potassium carbonate at 170℃; Product distribution; various catalysts;61 % Chromat.
18-crown-6 ether; potassium carbonate at 170℃;61 % Chromat.
With Mycobacterium smegmatis acyl transferase In aq. phosphate buffer at 21℃; for 1h; pH=7.5; Inert atmosphere; Enzymatic reaction;
ethyl acetate
141-78-6

ethyl acetate

(11E,13E)-(4R,5S,6S,7R,9R,16R)-4,6-Dihydroxy-7-(2-hydroxy-ethyl)-5-methoxy-9,16-dimethyl-oxacyclohexadeca-11,13-diene-2,10-dione
77405-59-5

(11E,13E)-(4R,5S,6S,7R,9R,16R)-4,6-Dihydroxy-7-(2-hydroxy-ethyl)-5-methoxy-9,16-dimethyl-oxacyclohexadeca-11,13-diene-2,10-dione

Acetic acid (7E,9E)-(3aR,5R,12R,16R,17S,17aS)-17-methoxy-5,12-dimethyl-2,6,14-trioxo-2,3,3a,5,6,11,12,14,15,16,17,17a-dodecahydro-4H-1,13-dioxa-cyclopentacyclohexadecen-16-yl ester
63838-05-1

Acetic acid (7E,9E)-(3aR,5R,12R,16R,17S,17aS)-17-methoxy-5,12-dimethyl-2,6,14-trioxo-2,3,3a,5,6,11,12,14,15,16,17,17a-dodecahydro-4H-1,13-dioxa-cyclopentacyclohexadecen-16-yl ester

Conditions
ConditionsYield
With oxygen; platinum at 25℃;100%
ethyl acetate
141-78-6

ethyl acetate

acetic acid ethyl ester; compound with boron chloride

acetic acid ethyl ester; compound with boron chloride

Conditions
ConditionsYield
With boron trichloride at -78 - 0℃;100%
ethyl acetate
141-78-6

ethyl acetate

methyl 1-methyl-2-oxo-1,2-dihydroquinoline-3-carboxylate

methyl 1-methyl-2-oxo-1,2-dihydroquinoline-3-carboxylate

3-acetyl-1-methyl-2(1H)-quinolone

3-acetyl-1-methyl-2(1H)-quinolone

Conditions
ConditionsYield
Stage #1: ethyl acetate; methyl 1-methyl-2-oxo-1,2-dihydroquinoline-3-carboxylate With sodium methylate for 7h; Heating;
Stage #2: With hydrogenchloride In ethyl acetate for 3h; Heating;
100%
ethyl acetate
141-78-6

ethyl acetate

isopropyl alcohol
67-63-0

isopropyl alcohol

Isopropyl acetate
108-21-4

Isopropyl acetate

Conditions
ConditionsYield
With dilithium tetra(tert-butyl)zincate at 0℃; for 1h; Inert atmosphere;100%
With 1,3-dicyclohexylimidazol-2-ylidene at 25℃; for 0.5h;68%
phosphotungstic acid at 65 - 70℃; for 2h;24%
ethyl acetate
141-78-6

ethyl acetate

2‐[3‐chloro‐5‐(trifluoromethyl)pyridin‐2‐yl]acetonitrile
157764-10-8

2‐[3‐chloro‐5‐(trifluoromethyl)pyridin‐2‐yl]acetonitrile

2-(3-chloro-5-trifluoromethyl-pyridin-2-yl)-3-oxo-butyronitrile
744209-92-5

2-(3-chloro-5-trifluoromethyl-pyridin-2-yl)-3-oxo-butyronitrile

Conditions
ConditionsYield
With sodium hydride In tetrahydrofuran100%
3-iodobenzoic acid methyl ester
58313-23-8

3-iodobenzoic acid methyl ester

ethyl acetate
141-78-6

ethyl acetate

3-(3-iodophenyl)-3-oxopropionic acid ethyl ester
68332-33-2

3-(3-iodophenyl)-3-oxopropionic acid ethyl ester

Conditions
ConditionsYield
With potassium tert-butylate In tetrahydrofuran at 0 - 20℃; for 2.25h;100%
[3R,4S]-1-(t-Butyloxycarbonyl)-3-ethenyl-4-piperidine Acetic Acid
233745-94-3

[3R,4S]-1-(t-Butyloxycarbonyl)-3-ethenyl-4-piperidine Acetic Acid

ethyl acetate
141-78-6

ethyl acetate

Methyl [3R,4S]-3-ethenyl-4-piperidine Acetate Hydrochloride

Methyl [3R,4S]-3-ethenyl-4-piperidine Acetate Hydrochloride

Conditions
ConditionsYield
With thionyl chloride In methanol100%
trans-dichloro(ethylene)(2,4,6-trimethylpyridine)platinum
52341-13-6, 12264-20-9

trans-dichloro(ethylene)(2,4,6-trimethylpyridine)platinum

ethyl acetate
141-78-6

ethyl acetate

trans-dichloro(ethyl acetate)(2,4,6-trimethylpyridine)platinum(II)
91068-20-1

trans-dichloro(ethyl acetate)(2,4,6-trimethylpyridine)platinum(II)

Conditions
ConditionsYield
In ethyl acetate byproducts: ethylene; Irradiation (UV/VIS);100%
In ethyl acetate Irradiation (UV/VIS); the Pt-complex dissolved in ethyl acetate was introduced into a muffshaped Schlenk tube surrounding a 125-W medium-pressure mercury lamp, Philips HPK 125, irradn. for 15 min at room temp., λ<310 nm was eliminated by Pyrex filter; the solvent was removed under reduced pressure at -30°C, the solid was recrystd. at -30°C in pentane-CH2Cl2;85%
potassium 3-(bis[(N'-tert-butylureaylato)-N-ethyl]aminatomethyl)-5-tert-butyl-1H-pyrazolato(hydroxo)cobaltate(II) N,N-dimethylacetamide adduct (1/2)

potassium 3-(bis[(N'-tert-butylureaylato)-N-ethyl]aminatomethyl)-5-tert-butyl-1H-pyrazolato(hydroxo)cobaltate(II) N,N-dimethylacetamide adduct (1/2)

ethyl acetate
141-78-6

ethyl acetate

potassium acetate
127-08-2

potassium acetate

Conditions
ConditionsYield
In diethyl ether; N,N-dimethyl acetamide; ethyl acetate (Ar); vapor diffusion of Et2O into a (CH3)2NCOCH3/EtOAc soln. of Co complex;100%
In N,N-dimethyl acetamide; ethyl acetate (Ar); stirred for 2 h at room temp.;
1,1-dimethylethyl 4-({[4-(cyanomethyl)-2-(methyloxy)phenyl]oxy}methyl)piperidine-1-carboxylate
838855-60-0

1,1-dimethylethyl 4-({[4-(cyanomethyl)-2-(methyloxy)phenyl]oxy}methyl)piperidine-1-carboxylate

ethyl acetate
141-78-6

ethyl acetate

C22H30N2O5

C22H30N2O5

Conditions
ConditionsYield
With sodium hydride In tetrahydrofuran at 60℃; for 15h;100%
(Z)-4-heptenal
6728-31-0

(Z)-4-heptenal

ethyl acetate
141-78-6

ethyl acetate

ethyl (+/-)-(Z)-3-hydroxy-non-6-enoate
1202014-45-6

ethyl (+/-)-(Z)-3-hydroxy-non-6-enoate

Conditions
ConditionsYield
Stage #1: ethyl acetate With lithium diisopropyl amide In tetrahydrofuran; hexane at -78℃; for 0.333333h;
Stage #2: (Z)-4-heptenal In tetrahydrofuran; hexane at -78℃; for 2h;
100%
ethyl 2-fluoroacetate
459-72-3

ethyl 2-fluoroacetate

ethyl acetate
141-78-6

ethyl acetate

ethyl 4-fluoro-3-oxo-butanoate
372-37-2

ethyl 4-fluoro-3-oxo-butanoate

Conditions
ConditionsYield
Stage #1: ethyl acetate With lithium diisopropyl amide In tetrahydrofuran at -78℃; for 1h; Inert atmosphere;
Stage #2: ethyl 2-fluoroacetate In tetrahydrofuran at -78 - 20℃; Inert atmosphere;
100%
Stage #1: ethyl acetate With lithium diisopropyl amide In tetrahydrofuran; diethyl ether; cyclohexane; ethylbenzene at -78℃; for 2h; Cooling with acetone-dry ice;
Stage #2: ethyl 2-fluoroacetate In tetrahydrofuran; diethyl ether; cyclohexane; ethylbenzene at -78 - 20℃;
86%
Stage #1: ethyl acetate With sodium ethanolate at 0 - 5℃; for 1h;
Stage #2: ethyl 2-fluoroacetate at 0 - 65℃; for 25h;
65.6%
Stage #1: ethyl acetate With lithium diisopropyl amide In diethyl ether at -78℃; for 0.75h;
Stage #2: ethyl 2-fluoroacetate In diethyl ether at -78 - 20℃; for 16h;
Stage #1: ethyl acetate With lithium diisopropyl amide In tetrahydrofuran; n-heptane; ethylbenzene at -78℃; for 0.5h; Inert atmosphere;
Stage #2: ethyl 2-fluoroacetate In tetrahydrofuran; n-heptane; ethylbenzene at -78 - 20℃; Inert atmosphere;
tris(triphenylphosphine)ruthenium(II) chloride
15529-49-4, 41756-81-4

tris(triphenylphosphine)ruthenium(II) chloride

bis(dithiobenzil)nickel

bis(dithiobenzil)nickel

ethyl acetate
141-78-6

ethyl acetate

[Ru(S2C2Ph2)2(PPh3)]*(ethyl acetate)

[Ru(S2C2Ph2)2(PPh3)]*(ethyl acetate)

Conditions
ConditionsYield
In toluene under Ar or N2; soln. of Ru compd. (0.156 mmol) and Ni compd. (0.303 mmol) in toluene heated at reflux for 4 h; cooling; addn. of small amt. of silica; evapn. under vac.; column chromy. (silica, CH2Cl2/light petroleum (1/4 and 3/7)); recrystn. from ethyl acetate and hydrocarbons (pentane, hexane, heptane); elem. anal.;100%
3,4,5-trimethoxyphenylbiguanide hydrochloride
1049734-37-3

3,4,5-trimethoxyphenylbiguanide hydrochloride

ethyl acetate
141-78-6

ethyl acetate

2-amino-4-(3',4',5'-trimethoxyphenyl)amino-6-methyl-1,3,5-triazine
1232144-64-7

2-amino-4-(3',4',5'-trimethoxyphenyl)amino-6-methyl-1,3,5-triazine

Conditions
ConditionsYield
With sodium methylate In tetrahydrofuran at 70℃; for 0.333333h; Microwave irradiation;100%
p-[(tert-butyldimethylsilyl)oxy]benzaldehyde
120743-99-9

p-[(tert-butyldimethylsilyl)oxy]benzaldehyde

ethyl acetate
141-78-6

ethyl acetate

ethyl 3-(4-{[tert-butyl(dimethyl)silyl]oxy}phenyl)-3-hydroxypropionate
221079-70-5

ethyl 3-(4-{[tert-butyl(dimethyl)silyl]oxy}phenyl)-3-hydroxypropionate

Conditions
ConditionsYield
In tetrahydrofuran at -78℃; for 1.5h; Inert atmosphere;100%
Stage #1: ethyl acetate With lithium hexamethyldisilazane In tetrahydrofuran; hexane at -78℃; for 0.333333h; Inert atmosphere;
Stage #2: p-[(tert-butyldimethylsilyl)oxy]benzaldehyde In tetrahydrofuran; hexane at -78℃; for 0.5h; Inert atmosphere;
100%
ethyl acetate
141-78-6

ethyl acetate

benzo[1,3,2]dioxaborole
274-07-7

benzo[1,3,2]dioxaborole

2-ethoxy-o-phenylene-1,3,2-dioxaborolane
72035-40-6

2-ethoxy-o-phenylene-1,3,2-dioxaborolane

Conditions
ConditionsYield
[Mo(H)(Cl)(P(CH3)3)3(N(C6H3(CH3CHCH3)2))] In benzene-d6 react. of HBCat with 0.4 M soln. of MeC(O)OEt (2:1 molar ratio) in C6D6 at temp. of 22°C for 24 h in presence of 5 mol% of Mo complex as catalyst; detd. by NMR;100%
With tetramethylsilane; (2,6-diisopropylphenyl-N=)Mo(H)(Cl)(PMe3)3 In benzene-d6 at 22℃; for 24h; Inert atmosphere;
With (2,6-diisopropylphenyl-N=)Mo(H)(Cl)(PMe3)3 In benzene-d6 at 22℃; for 2h; Catalytic behavior; Reagent/catalyst; Time; Inert atmosphere;100 %Spectr.

Ethyl acetate Specification

Ethyl acetate, with the CAS registry number 141-78-6, is a clear colorless liquid with a fruity odor. Its EINECS registry number is 205-500-4. This chemical is soluble in water which is an organic compound with the formula CH3COOCH2CH3. Ethyl acetate is stable under normal temperature conditions and recommended use. In addition, it is a flammable liquid with a flash point lower than 37.8°C (100°F). The substance may be toxic to blood, kidneys, liver, central nervous system (CNS). Ethyl acetate should be stored in a segregated and approved area, and should keep its container in a cool, well-ventilated area, which should be tightly closed and sealed until ready for use.

Physical properties about Ethyl acetate are:
(1)ACD/LogP: 0.785; (2)ACD/LogD (pH 5.5): 0.79; (3)ACD/LogD (pH 7.4): 0.79; (4)ACD/BCF (pH 5.5): 2.33; (5)ACD/BCF (pH 7.4): 2.33; (6)ACD/KOC (pH 5.5): 63.70; (7)ACD/KOC (pH 7.4): 63.70; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 2; (10)Index of Refraction: 1.373; (11)Molar Refractivity: 22.355 cm3; (12)Molar Volume: 98.045 cm3; (13)Polarizability: 8.862 10-24cm3; (14)Surface Tension: 23.568000793457 dyne/cm; (15)Density: 0.899 g/cm3; (16)Flash Point: -3.333 °C; (17)Enthalpy of Vaporization: 31.94 kJ/mol; (18)Boiling Point: 73.935 °C at 760 mmHg; (19)Vapour Pressure: 111.716003417969 mmHg at 25°C

Production of Ethyl acetate:
In industry, Ethyl acetate is synthesized mainly by ethanol and acetic acid via the classic Fischer esterification reaction. This reaction occurs at room temperature with the yield about 65%, that will more quickly by acid catalysis.
CH3CH2OH + CH3COOH → CH3COOCH2CH3 + H2O
Additionally, Ethyl acetate is also prepared industrially by combining two equivalents of acetaldehyde in the presence of an alkoxide catalyst using the Tishchenko reaction. The yield is about 95%-96%. This method is less cost than others.
2 CH3CHO [Al(OR)3] → CH3COOCH2CH3
What's more, it can also be produced by ethylic acid and ethene via the esterification reaction. The reaction equation is as the following:
CH3COOH + C2H4 → CH3COOC2H5

Uses of Ethyl acetate:
 Ethyl acetate is the ester of ethanol and acetic acid. Because of its low cost, low toxicity, and agreeable odor, it is used as a solvent and diluent. Ethyl acetate is also used in glues or nail polish removers. Since it is prone to hydrolysis and transesterification, Ethyl acetate is rarely selected as a reaction solvent. In the laboratory, mixtures that contains ethyl acetate are used in column chromatography and extractions.Ethyl acetate is the most common ester in wine. The aroma of ethyl acetate is most vivid in younger wines and contributes towards the general perception of "fruitiness" in the wine. Ethyl acetate is an effective asphyxiant for use in insect collecting and study. Because it is not hygroscopic, Ethyl acetate also keeps the insect soft enough to allow proper mounting suitable for a collection. It is also used in paints as an activator or hardener.

Safety information of Ethyl acetate:
When you are using Ethyl acetate, you should be very cautious. This chemical is irritating to eyes which is also highly flammable. Repeated exposure may cause skin dryness or cracking. Its vapour may cause drowsiness and dizziness. It should be kept away from sources of ignition - no smoking. In case of contact with eyes, you need rinse immediately with plenty of water and seek medical advice. Whenever you need, you can take precautionary measures against static discharges.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCOC(=O)C
(2)InChI: InChI=1S/C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3
(3)InChIKey: XEKOWRVHYACXOJ-UHFFFAOYSA-N

The toxicity data of Ethyl acetate is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LCLo inhalation 61gm/m3 (61000mg/m3)   "Handbook of Toxicology," 4 vols., Philadelphia, W.B. Saunders Co., 1956-59Vol. 1, Pg. 336, 1955.
cat LD50 subcutaneous 3gm/kg (3000mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

GASTROINTESTINAL: NAUSEA OR VOMITING

BLOOD: OTHER CHANGES
Archiv fuer Gewerbepathologie und Gewerbehygiene. Vol. 5, Pg. 1, 1933.
guinea pig LD50 oral 5500mg/kg (5500mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

BEHAVIORAL: COMA
Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 48(4), Pg. 66, 1983.
guinea pig LD50 subcutaneous 3gm/kg (3000mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Archiv fuer Gewerbepathologie und Gewerbehygiene. Vol. 5, Pg. 1, 1933.
human TCLo inhalation 400ppm (400ppm) SENSE ORGANS AND SPECIAL SENSES: OTHER CHANGES: OLFACTION

SENSE ORGANS AND SPECIAL SENSES: CONJUNCTIVE IRRITATION: EYE

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES
Journal of Industrial Hygiene and Toxicology. Vol. 25, Pg. 282, 1943.
mouse LC50 inhalation 45gm/m3/2H (45000mg/m3)   "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 65, 1982.
mouse LD50 intraperitoneal 709mg/kg (709mg/kg)   Shell Chemical Company. Unpublished Report. Vol. -, Pg. 5, 1961.
mouse LD50 oral 4100mg/kg (4100mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

BEHAVIORAL: COMA
Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 48(4), Pg. 66, 1983.
rabbit LD50 oral 4935mg/kg (4935mg/kg)   Industrial Medicine and Surgery. Vol. 41, Pg. 31, 1972.
rabbit LD50 skin > 20mL/kg (20mL/kg)   Union Carbide Data Sheet. Vol. 10/4/1968,
rat LC50 inhalation 200gm/m3 (200000mg/m3) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS

LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA
Science Reports of the Research Institutes, Tohoku University, Series C: Medicine. Vol. 36(1-4), Pg. 10, 1989.
rat LD50 oral 5620mg/kg (5620mg/kg)   Yakkyoku. Pharmacy. Vol. 32, Pg. 1241, 1981.
rat LDLo subcutaneous 5gm/kg (5000mg/kg)   Bolletino della Societe Italiana di Biologia Sperimentale. Vol. 18, Pg. 45, 1943.

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