Product Name

  • Name

    Propanoic acid, propylester

  • EINECS 203-389-7
  • CAS No. 106-36-5
  • Article Data117
  • CAS DataBase
  • Density 0.886 g/cm3
  • Solubility
  • Melting Point -76 °C(lit.)
  • Formula C6H12O2
  • Boiling Point 121.9 °C at 760 mmHg
  • Molecular Weight 116.16
  • Flash Point 19.4 °C
  • Transport Information UN 3272 3/PG 2
  • Appearance Clear colorless liquid
  • Safety 24
  • Risk Codes 10-20
  • Molecular Structure Molecular Structure of 106-36-5 (Propanoic acid, propylester)
  • Hazard Symbols HarmfulXn
  • Synonyms Propionicacid, propyl ester (6CI,8CI);NSC 72022;Propyl propanoate;n-Propyl n-propanoate;n-Propyl propionate;
  • PSA 26.30000
  • LogP 1.34960

Synthetic route

propan-1-ol
71-23-8

propan-1-ol

propyl propionate
106-36-5

propyl propionate

Conditions
ConditionsYield
With dihydrogen peroxide; bromine In dichloromethane; water at 20℃; for 2h;99%
With water; potassium iodide at 20℃; for 3h; Electrochemical reaction; Green chemistry;72%
With calcium dichloride dihydrate; oxone; 2,2,6,6-Tetramethyl-1-piperidinyloxy free radical; water In dichloromethane at 20℃; for 4h;72%
propionaldehyde
123-38-6

propionaldehyde

propyl propionate
106-36-5

propyl propionate

Conditions
ConditionsYield
With [{(PhN)MeC(Nt-Bu)}AlMe(μ-OMe)]2 at 20℃; for 0.5h; Tishchenko-Claisen Dismutation; Inert atmosphere; Schlenk technique; Green chemistry;99%
With aluminium propanolate
With Mg-tetrakis(methoxy)borate; mercury dichloride In diethyl ether
With Rh(PhBP3)(H)2(NCMe) In benzene-d6 at 20℃; for 0.0166667h; Tishchenko reaction; Inert atmosphere;
propan-1-ol
71-23-8

propan-1-ol

propionic acid
802294-64-0

propionic acid

propyl propionate
106-36-5

propyl propionate

Conditions
ConditionsYield
With Dowex 50Wx2 hydrogen form resin at 108 - 113℃; Reagent/catalyst; Autoclave; Large scale;97.36%
With salicylic acid resin supported FeCl3 In benzene at 125℃; for 2.11667h;95.8%
With Rhizomucor miehei lipase In n-heptane at 40℃; for 24h; Enzymatic reaction;95.3%
(PPh3)3CoH(N2)
21373-88-6, 16920-54-0

(PPh3)3CoH(N2)

phenyl propionate
637-27-4

phenyl propionate

A

HCo(CO)(P(C6H5)3)3
53729-69-4, 21329-67-9

HCo(CO)(P(C6H5)3)3

B

propyl propionate
106-36-5

propyl propionate

C

phenoxotris(triphenylphosphine)cobalt(I)
91583-66-3

phenoxotris(triphenylphosphine)cobalt(I)

D

ethane
74-84-0

ethane

E

nitrogen
7727-37-9

nitrogen

Conditions
ConditionsYield
In toluene byproducts: H2; EtCO2Ph added to CoH(N2)(PPh3)3 in toluene in vac., reacted for 3 days at room temp.; liquid phase analysed by GLC; hexane added, ppt. filtered, washed with hexane, dried in vac., recrystd. from C6H6-hexane;A n/a
B 33%
C 62%
D 23%
E 85%
(PPh3)3CoH(N2)
21373-88-6, 16920-54-0

(PPh3)3CoH(N2)

propionic acid anhydride
123-62-6

propionic acid anhydride

A

Co(1+)*C2H5CO2(1-)=Co(OCOC2H5)
99668-70-9

Co(1+)*C2H5CO2(1-)=Co(OCOC2H5)

B

propyl propionate
106-36-5

propyl propionate

C

ethane
74-84-0

ethane

D

nitrogen
7727-37-9

nitrogen

E

hydrogen
1333-74-0

hydrogen

Conditions
ConditionsYield
In toluene in toluene at room temp. for 1 day;A n/a
B 28%
C 26%
D 84%
E 15%
normal propyl hypochlorite
25538-50-5

normal propyl hypochlorite

propyl propionate
106-36-5

propyl propionate

Conditions
ConditionsYield
In tetrachloromethane for 4h; Irradiation;75%
In benzene Ambient temperature; Irradiation;75%
trimethylsilyl propionate
16844-98-7

trimethylsilyl propionate

propyl propionate
106-36-5

propyl propionate

Conditions
ConditionsYield
With hydrogen; chromium(III) oxide; nickel(III) oxide
propionyl chloride
79-03-8

propionyl chloride

propyl propionate
106-36-5

propyl propionate

Conditions
ConditionsYield
With triphenylstannane
propan-1-ol
71-23-8

propan-1-ol

A

propyl propionate
106-36-5

propyl propionate

B

propionaldehyde
123-38-6

propionaldehyde

Conditions
ConditionsYield
With dodecacarbonyl-triangulo-triruthenium; diphenyl acetylene at 145℃; for 4h; Product distribution; Mechanism; other alcohols; other reagents; var. time;
With [Ru(1,2-bis(diphenylphosphino)benzene )(CO)2Cl2]; potassium tert-butylate; acetone In toluene at 100℃; for 6h;A 68 %Chromat.
B 8 %Chromat.
With [Ru(1,2-bis(diphenylphosphino)benzene )(CO)2Cl2]; potassium tert-butylate; acetone In toluene at 100℃; for 6h;A 29 %Chromat.
B 62 %Chromat.
tert-Butyl peroxybenzoate
614-45-9

tert-Butyl peroxybenzoate

aluminium propanolate
4073-85-2

aluminium propanolate

A

propan-1-ol
71-23-8

propan-1-ol

B

propyl propionate
106-36-5

propyl propionate

C

propyl benzoate
2315-68-6

propyl benzoate

D

tert-butyl alcohol
75-65-0

tert-butyl alcohol

Conditions
ConditionsYield
In benzene at 20℃; for 336h; Product distribution; Mechanism; other temperature and time;
20 deg C, 3 d, then 70 deg C, 30 h; Yield given. Yields of byproduct given;
tert-butyl peroxyacetate
107-71-1

tert-butyl peroxyacetate

aluminium propanolate
4073-85-2

aluminium propanolate

A

propan-1-ol
71-23-8

propan-1-ol

B

propyl propionate
106-36-5

propyl propionate

C

1-Propyl acetate
109-60-4

1-Propyl acetate

D

tert-butyl alcohol
75-65-0

tert-butyl alcohol

Conditions
ConditionsYield
In benzene at 20℃; for 168h; Product distribution; Mechanism;
ethene
74-85-1

ethene

carbon monoxide
201230-82-2

carbon monoxide

A

propyl propionate
106-36-5

propyl propionate

B

propionaldehyde
123-38-6

propionaldehyde

C

propionic acid
802294-64-0

propionic acid

D

pentan-3-one
96-22-0

pentan-3-one

Conditions
ConditionsYield
cobalt catalyst In butanone at 160℃; for 2.41667h; Yield given;
cobalt catalyst In ethanol at 160℃; Product distribution; other temperature, other solvent, other catalyst concentration, influence of water, effect of partial pressure of ethylene and carbon monooxide;
diethylmethylsilane
760-32-7

diethylmethylsilane

A

propyl propionate
106-36-5

propyl propionate

B

methyldiethylchlorosilane
17680-28-3

methyldiethylchlorosilane

Conditions
ConditionsYield
With propionyl chloride; bis(acetylacetonate)nickel(II) at 90℃; for 2h;A 74 % Chromat.
B 87 % Chromat.
propanoic acid methyl ester
554-12-1

propanoic acid methyl ester

A

methanol
67-56-1

methanol

B

propan-1-ol
71-23-8

propan-1-ol

C

propyl propionate
106-36-5

propyl propionate

Conditions
ConditionsYield
With hydrogen; <(Ph3P)(Ph2P)RuH2-K+*diglyme>2 In toluene at 90℃; under 4650.4 Torr; for 20h; Title compound not separated from byproducts;
propionyl chloride
79-03-8

propionyl chloride

A

propyl propionate
106-36-5

propyl propionate

B

methyldiethylchlorosilane
17680-28-3

methyldiethylchlorosilane

Conditions
ConditionsYield
With diethylmethylsilane; bis(acetylacetonate)nickel(II) at 90℃; for 2h;A 79 % Chromat.
B 87 % Chromat.
ethene
74-85-1

ethene

propionaldehyde
123-38-6

propionaldehyde

A

propan-1-ol
71-23-8

propan-1-ol

B

propyl propionate
106-36-5

propyl propionate

C

2-methyl-2-pentenal
14250-96-5, 16958-22-8, 623-36-9

2-methyl-2-pentenal

D

propionic acid
802294-64-0

propionic acid

E

pentan-3-one
96-22-0

pentan-3-one

Conditions
ConditionsYield
With tris(triphenylphosphine)ruthenium(II) chloride at 210℃; for 18h; Product distribution; other aldehydes and olefines;
propan-1-ol
71-23-8

propan-1-ol

propionic acid anhydride
123-62-6

propionic acid anhydride

propyl propionate
106-36-5

propyl propionate

Conditions
ConditionsYield
sulfuric acid
carbon monoxide
201230-82-2

carbon monoxide

glycerol
56-81-5

glycerol

A

tetrahydrofuran
109-99-9

tetrahydrofuran

B

propan-1-ol
71-23-8

propan-1-ol

C

propyl propionate
106-36-5

propyl propionate

D

Dipropyl ether
111-43-3

Dipropyl ether

E

3-n-propoxy-1,2-propanediol
61940-71-4

3-n-propoxy-1,2-propanediol

F

butan-1-ol
71-36-3

butan-1-ol

Conditions
ConditionsYield
With diiodidotetracarbonylruthenium(II); hydrogen In water at 200℃; for 8h; Product distribution; other conditions; var. polyols and sugars;A 10.2 mmol
B 61.3 mmol
C 8.5 mmol
D 4.9 mmol
E 42.3 mmol
F 6.2 mmol
propionaldehyde
123-38-6

propionaldehyde

A

propyl propionate
106-36-5

propyl propionate

B

propionic acid
802294-64-0

propionic acid

C

pentan-3-one
96-22-0

pentan-3-one

D

butanone
78-93-3

butanone

Conditions
ConditionsYield
With chromium-zinc-manganese oxide; water at 300℃; Mechanism; Product distribution; other aliphatic aldehydes; var. temp.;
normal propyl hypochlorite
25538-50-5

normal propyl hypochlorite

benzaldehyde
100-52-7

benzaldehyde

A

propyl propionate
106-36-5

propyl propionate

B

propyl benzoate
2315-68-6

propyl benzoate

Conditions
ConditionsYield
In benzene Ambient temperature; Irradiation;
normal propyl hypochlorite
25538-50-5

normal propyl hypochlorite

butyraldehyde
123-72-8

butyraldehyde

A

propyl propionate
106-36-5

propyl propionate

B

propyl butanoate
105-66-8

propyl butanoate

Conditions
ConditionsYield
In benzene Ambient temperature; Irradiation;

Propyl propionate Chemical Properties

Molecular Structure:

Molecular Formula: C6H12O2
Molecular Weight: 116.1583
IUPAC Name: Propyl propanoate
Synonyms of Propyl propionate (CAS NO.106-36-5): 4-02-00-00707 (Beilstein Handbook Reference) ; AI3-24357 ; BRN 1699993 ; EINECS 203-389-7 ; FEMA No. 2958 ; NSC 72022 ; Propanoic acid, propyl ester ; Propionic acid, propyl ester ; Propyl propanoate ; Propyl propionate (natural) ; Propylester kyseliny propionove ; Propylester kyseliny propionove [Czech] ; n-Propyl propanoate ; n-Propyl propionate
CAS NO: 106-36-5
Classification Code: Skin / Eye Irritant
Melting point: −76 °C 
Index of Refraction: 1.397
Molar Refractivity: 31.62 cm3
Molar Volume: 131 cm3
Surface Tension: 25.8 dyne/cm
Density: 0.886 g/cm3
Flash Point: 19.4 °C
Enthalpy of Vaporization: 35.54 kJ/mol
Boiling Point: 121.9 °C at 760 mmHg
Vapour Pressure: 14.3 mmHg at 25°C

Propyl propionate Uses

  Propyl propionate (CAS NO.106-36-5) is used in the coating printing ink profession one fine resolver.

Propyl propionate Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LC50 inhalation 16900mg/m3 (16900mg/m3)   Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 51(5), Pg. 61, 1986.
mouse LC50 inhalation 24gm/m3/2H (24000mg/m3)   "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 104, 1982.
rabbit LD50 oral 3950mg/kg (3950mg/kg)   Industrial Medicine and Surgery. Vol. 41, Pg. 31, 1972.
rabbit LD50 skin > 14128mg/kg (14128mg/kg)   Acute Toxicity Data. Journal of the American College of Toxicology, Part B. Vol. 1, Pg. 177, 1992.
rat LD50 oral 10331mg/kg (10331mg/kg) SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE
BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"
Acute Toxicity Data. Journal of the American College of Toxicology, Part B. Vol. 1, Pg.

Propyl propionate Consensus Reports

Reported in EPA TSCA Inventory.

Propyl propionate Safety Profile

Hazard Codes of Propyl propionate (CAS NO.106-36-5): HarmfulXn
Risk Statements: 10-20 
R10: Flammable. 
R20: Harmful by inhalation.
Safety Statements: 24 
S24: Avoid contact with skin.
RIDADR: UN 3272 3/PG 2
WGK Germany: 1
RTECS: UF7100000
HazardClass: 3
PackingGroup: II
Moderately toxic by ingestion. Very mildly toxic by inhalation. A skin irritant. Combustible when exposed to heat or flame; can react with oxidizing materials. To fight fire, use foam, CO2, dry chemical. When heated to decomposition it emits acrid smoke and irritating fumes. See also ESTERS.

Post buying leads

About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia

Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog

©2008 LookChem.com,License: ICP

NO.:Zhejiang16009103

complaints:service@lookchem.com Desktop View