Conditions | Yield |
---|---|
With oxygen; toluene-4-sulfonic acid; acetic acid at 20℃; for 2h; Baeyer-Villiger Ketone Oxidation; | 97% |
propan-1-ol
sodium salt of β-mercaptonaphthalene
A
propyl methanoate
B
naphthalene-2-yl(propyl)sulfane
Conditions | Yield |
---|---|
With carbon monoxide at 150℃; under 75006 Torr; for 10h; | A n/a B 95% |
Conditions | Yield |
---|---|
With pyridine; N,N'-dibromo-N,N'-(1,2-ethanediyl)bis(p-toluenesulfonamide); triphenylphosphine In dichloromethane at 20℃; | 91% |
With sulfuric acid In water for 4h; Reflux; | 75% |
With sulfuric acid In 1,4-dioxane at 60℃; Equilibrium constant; |
propan-1-ol
D-Fructose
A
5-(n-propoxymethyl)-2-furancarboxadehyde
B
Dipropyl ether
C
propyl methanoate
D
n-propyl levulinate
Conditions | Yield |
---|---|
With poly(p-styrenesulfonic acid)-grafted carbon nanotubes at 120℃; for 24h; Sealed tube; Green chemistry; chemoselective reaction; | A n/a B n/a C n/a D 86% |
Conditions | Yield |
---|---|
With Cu/Al2O3; dihydrogen peroxide In chloroform at 80℃; for 24h; | 83% |
propan-1-ol
phenylacetylene
A
propyl methanoate
B
propyl benzoate
Conditions | Yield |
---|---|
With bis-[(trifluoroacetoxy)iodo]benzene at 60℃; for 15h; Sealed tube; | A n/a B 72% |
5,10,15,20-tetra(2,4,6-trimethylphenyl)porphyrinate rhodium(II)
Dipropyl ether
(5,10,15,20-tetra(2,4,6-trimethylphenyl)porphyrinato)rhodium(III) ethyl
B
propyl methanoate
Conditions | Yield |
---|---|
With water; tetraphenylphosphonium bromide; triphenylphosphine; potassium hydroxide at 25℃; Inert atmosphere; Darkness; regioselective reaction; | A 62% B n/a |
2-(tert-butylperoxy)tetrahydrofuran
A
4-butanolide
B
propyl methanoate
D
acetone
E
tert-butyl alcohol
Conditions | Yield |
---|---|
In various solvent(s) at 120℃; for 14h; Mechanism; Product distribution; | A 30% B 11% C 12% D 7% E 61% |
propan-1-ol
D-glucose
A
formic acid
B
propyl methanoate
C
1-Propyl acetate
D
carbon dioxide
E
carbon monoxide
F
acetic acid
Conditions | Yield |
---|---|
With H8[PMo7V5O40]; oxygen In water at 90℃; under 15001.5 Torr; for 24h; Autoclave; | A n/a B n/a C n/a D 24% E 21% F n/a |
tripropyl orthoformate
benzoyl chloride
A
1-Chloropropane
B
propyl methanoate
C
propyl benzoate
tripropyl orthoformate
acetaldehyde
A
acetaldehyde dipropyl acetal
B
propyl methanoate
Conditions | Yield |
---|---|
With sulfuric acid |
Conditions | Yield |
---|---|
In water Product distribution; Mechanism; Irradiation; γ irradiation; |
1,3-dioxane
A
propan-1-ol
B
formaldehyd
C
1,3-dioxine
D
ethene
E
propyl methanoate
F
allyl alcohol
Conditions | Yield |
---|---|
Mechanism; Product distribution; Quantum yield; Heating; 185 nm vacuum-ultraviolet photolysis; |
Conditions | Yield |
---|---|
With di-tert-butyl peroxide at 120℃; Product distribution; Rate constant; other temperature, various concentrations of peroxide, in the presence of ethyl orthoformate; | |
With di-tert-butyl peroxide at 120℃; Yield given. Yields of byproduct given. Title compound not separated from byproducts; |
dipropoxymethane
tris(ethylsulfanyl)methane
A
bis(ethylthio)methane
B
ethyl propyl sulfide
C
propyl methanoate
Conditions | Yield |
---|---|
With boron trifluoride diethyl etherate In various solvent(s) at 30℃; Product distribution; equilibrium concentrations; various temperature and reactant ratios, other catalysts; |
Conditions | Yield |
---|---|
With ozone In tetrachloromethane at 25℃; Rate constant; k= 0.7 liter/mole.sec; | |
With ozone In tetrachloromethane at 18℃; Rate constant; Mechanism; |
Conditions | Yield |
---|---|
With di-tert-butyl peroxide at 130℃; Rate constant; kinetic isotope effect; further temperatures; |
tripropyl orthoformate
A
propane
B
propyl methanoate
C
Dipropyl carbonate
D
propionaldehyde
Conditions | Yield |
---|---|
With di-tert-butyl peroxide In chlorobenzene at 140℃; for 4h; Kinetics; Mechanism; Product distribution; various temperatures, rates of formation; |
carbon monoxide
A
ethanol
B
Methyl formate
C
propyl methanoate
D
ethylene glycol
Conditions | Yield |
---|---|
With 2-hydroxypyridin; hydrogen; acetylacetonatodicarbonylrhodium(l) In various solvent(s) at 230℃; under 1499480 Torr; for 4.5h; Further byproducts given. Title compound not separated from byproducts; | A 191 mmol B 52 mmol C 29 mmol D 1000 mmol |
1,3-Bis(1,3-dioxan-2-yloxy)propane
A
trimethylene carbonate
B
propyl methanoate
C
2-propoxy-1,3-dioxane
D
3-([1,3]Dioxan-2-yloxy)-propionaldehyde
E
propyl 3-(1,3-dioxan-2-yloxy)propyl carbonate
Conditions | Yield |
---|---|
With di-tert-butyl peroxide at 130℃; for 0.5h; Product distribution; | A 0.02 mol B 0.01 mol C 0.02 mol D 0.01 mol E 0.06 mol |
2-propoxy-1,3-dioxane
A
trimethylene carbonate
B
propane
C
propyl methanoate
D
Dipropyl carbonate
E
propionaldehyde
Conditions | Yield |
---|---|
With di-tert-butyl peroxide In chlorobenzene at 130℃; Product distribution; Rate constant; Mechanism; |
Conditions | Yield |
---|---|
With di-tert-butyl peroxide at 140℃; for 3h; conversion, concentration of products; |
2-propoxyethanol
A
2-ethyl-1,3-dioxolane
B
propyl methanoate
C
n-propoxyacetaldehyde
Conditions | Yield |
---|---|
With hydroxide at 23.85℃; under 760 Torr; Rate constant; Product distribution; Mechanism; | A 5.4 % Chromat. B 47 % Chromat. C 15 % Chromat. |
Conditions | Yield |
---|---|
Geschwindigkeit der Umsetzung; |
Dipropyl ether
A
propyl propionate
B
propyl methanoate
C
acetaldehyde
D
propionaldehyde
Conditions | Yield |
---|---|
With nitric oxide Kinetics; Oxidation; UV-irradiation; |
Conditions | Yield |
---|---|
With hydrogen; triethylamine; TpRu(PPh3)(CH3CN)H at 100℃; under 38000 Torr; for 16h; |
Conditions | Yield |
---|---|
With hydrogen; potassium carbonate at 169.84℃; under 22502.3 Torr; for 2h; |
Conditions | Yield |
---|---|
Conversion of starting material; |
Conditions | Yield |
---|---|
With oxygen; [Ru(CO)2Cp]2 under 375.038 Torr; for 168h; |
Conditions | Yield |
---|---|
With Cp*2Sm(THF)2 In toluene Ambient temperature; further reagent: SmI2; | 99% |
Conditions | Yield |
---|---|
With Cp*2Sm(THF)2 In toluene Ambient temperature; | 99% |
propyl methanoate
Conditions | Yield |
---|---|
Stage #1: (S)-2-tert-butoxycarbonylamino-pentanedioic acid 1-benzyl ester 5-ethyl ester With sodium t-butanolate In tetrahydrofuran at -70℃; for 3h; Inert atmosphere; Stage #2: propyl methanoate In tetrahydrofuran at -70℃; for 5h; Stage #3: With trifluoroacetic acid In dichloromethane at 5 - 25℃; for 4h; | 95.7% |
Conditions | Yield |
---|---|
With magnesium; lithium chloride In tetrahydrofuran; dichloromethane at 20 - 67℃; for 1.5h; Time; | 91.1% |
propyl methanoate
1-(Aminomethyl)isoquinoline dihydrochloride
2-formamidomethylisoquinoline
Conditions | Yield |
---|---|
With TEA In ethanol for 2h; Heating; | 89% |
propyl methanoate
p-trifluoromethylphenyl bromide
1-propyl 4-(trifluoromethyl)benzoate
Conditions | Yield |
---|---|
Stage #1: p-trifluoromethylphenyl bromide With n-butyllithium In tetrahydrofuran; hexane at -78℃; for 0.5h; Stage #2: propyl methanoate In tetrahydrofuran; hexane at -78℃; for 3h; Stage #3: With propan-1-ol; iodine; potassium carbonate In tetrahydrofuran; hexane at -78 - 20℃; for 14h; | 86% |
propyl methanoate
2,2-diethoxy-ethanamine
2,2-diethoxy-1-formylaminoethane
Conditions | Yield |
---|---|
for 3h; Reflux; | 86% |
Conditions | Yield |
---|---|
With hydrogenchloride; iron(III) chloride hexahydrate In hexane; water at 80℃; for 14h; | 86% |
Adipic acid
propyl methanoate
A
Hexanedioic acid monopropyl ester
B
di-n-propyl adipate
Conditions | Yield |
---|---|
With Dowex 50W-X2 (50-100 mesh) In octane at 70℃; for 2.66667h; | A 85% B 6% |
With Dowex 50Wx2 In octane at 70℃; for 2.66667h; Esterification; | A 85% B 6% |
propyl methanoate
quinolin-2-ylmethanamine bischlorohydrate
N-(2-Quinolylmethyl)formamide
Conditions | Yield |
---|---|
With TEA In ethanol for 2h; Heating; | 83% |
Conditions | Yield |
---|---|
With tert.-butylhydroperoxide; copper(II) bis(trifluoromethanesulfonate) In 1,2-dichloro-ethane at 130℃; for 12h; Sealed tube; | 82% |
Conditions | Yield |
---|---|
With Cp*2Sm(THF)2 In toluene Ambient temperature; | 80% |
Conditions | Yield |
---|---|
at 115℃; for 2h; | 80% |
Conditions | Yield |
---|---|
With N-methyl-N-phenylformamide at 60℃; for 9h; | 76% |
propyl methanoate
3-formamidomethylisoquinoline
Conditions | Yield |
---|---|
With TEA In ethanol for 2h; Heating; | 75% |
Conditions | Yield |
---|---|
Stage #1: deoxyvasicinone; propyl methanoate With sodium at 0 - 20℃; Stage #2: With water Cooling with ice; | 75% |
propyl methanoate
2-(Aminomethyl)-4-methoxyquinoline dihydrochloride
<(4-Methoxy-2-quinolyl)methyl>formamide
Conditions | Yield |
---|---|
With TEA In ethanol for 2h; Heating; | 74% |
propyl methanoate
dichloromethyl propyl ether
Conditions | Yield |
---|---|
With oxalyl dichloride; N-methyl-N-phenylformamide at 60℃; for 17h; | 74% |
With oxalyl dichloride; N-methyl-N-phenylformamide |
propyl methanoate
Conditions | Yield |
---|---|
for 24h; Inert atmosphere; Reflux; | 73% |
Conditions | Yield |
---|---|
With tris(2,2'-bipyridyl)ruthenium dichloride; trimethylsilyl cyanide; 4-cyano-1-isopropoxypyridin-1-ium trifluoromethanesulfonate at 20℃; for 12h; Schlenk technique; Inert atmosphere; Irradiation; | 72% |
propyl methanoate
Conditions | Yield |
---|---|
With potassium carbonate for 21h; Inert atmosphere; Reflux; | 68% |
propyl methanoate
Conditions | Yield |
---|---|
With potassium carbonate for 41h; Inert atmosphere; Reflux; | 68% |
Conditions | Yield |
---|---|
dodecacarbonyl-triangulo-triruthenium; P(C4H9)3 In pyridine at 180℃; for 8h; | 67% |
dimethylacetylene
propyl methanoate
(2E,5E)-3,5-dimethylhepta-2,5-dien-4-ol
Conditions | Yield |
---|---|
With isobutylmagnesium bromide; titanocene dichloride | 65% |
IUPAC Name: Propyl formate
Synonyms of N-Propyl formate (CAS NO.110-74-7) : Formic acid, propyl ester ; Propyl formate ; Formic acid n-propyl ester ; Formic acid propyl ester ; N-Propyl formate
Product Categories: Organics
CAS NO:110-74-7
Molecular Formula:C4H8O2
Molecular Weight:88.11
Molecular Structure:
EINECS: 203-798-0
Index of Refraction: 1.375
Surface Tension: 25 dyne/cm
Density: 0.896 g/cm3
Flash Point: 25 °F
Enthalpy of Vaporization: 33.61 kJ/mol
Boiling Point: 81.9 °C at 760 mmHg
Vapour Pressure: 80.3 mmHg at 25°C
Melting point: -93 °C(lit.)
Storage temp: Flammables area
Appearance:A clear colorless liquid
Water solubility:Slightly soluble in water.
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | oral | 3400mg/kg (3400mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) | Food and Cosmetics Toxicology. Vol. 2, Pg. 327, 1964. |
rat | LD50 | oral | 3980mg/kg (3980mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) | Food and Cosmetics Toxicology. Vol. 2, Pg. 327, 1964. |
Reported in EPA TSCA Inventory.
Moderately toxic by ingestion. An irritant to skin, eyes, and mucous membranes. Narcotic in high concentration. Dangerous fire hazard when exposed to heat, flame, or oxidizers. Ignites on contact with potassium-tert-butoxide. Explosive in the form of vapor when exposed to heat or flame. To fight fire, use alcohol foam. When heated to decomposition it emits acrid smoke and irritating fumes. See also ESTERS.
Hazard CodesF,Xi
Risk Statements 11-36/37-67
R11: N-Propyl formate (CAS NO.110-74-7) is highly flammable.
R36/37:Irritating to eyes and respiratory system.
R67:Vapours may cause drowsiness and dizziness.
Safety Statements 9-16-24-33
S9:Keep container in a well-ventilated place.
S16:Keep away from sources of ignition.
S24:Avoid contact with skin.
S33:Take precautionary measures against static discharges.
RIDADR UN 1281 3/PG 2
WGK Germany 1
RTECS LR0175000
HazardClass 3
PackingGroup II
DOT Classification: 3; Label: Flammable Liquid
1.General Description : Slightly soluble in water and less dense than water. Hence floats on water. Vapors are heavier than air. 2.Air & Water Reactions: Highly flammable.
3.Reactivity Profile : Propyl formates are esters. React with acids to liberate heat along with propanols and formic acid. Strong oxidizing acids may cause a reaction that is sufficiently exothermic to ignite the reaction products. Heat is also generated by interaction with caustic solutions. Flammable hydrogen is generated by mixing with alkali metals and hydrides.
4.Health Hazard :May cause toxic effects if inhaled or absorbed through skin. Inhalation or contact with material may irritate or burn skin and eyes. Fire will produce irritating, corrosive and/or toxic gases. Vapors may cause dizziness or suffocation. Runoff from fire control or dilution water may cause pollution.
5.Fire Hazard: Highly flammable: N-Propyl formate (CAS NO.110-74-7) will be easily ignited by heat, sparks or flames. Vapors may form explosive mixtures with air. Vapors may travel to source of ignition and flash back. Most vapors are heavier than air. They will spread along ground and collect in low or confined areas (sewers, basements, tanks). Vapor explosion hazard indoors, outdoors or in sewers. Runoff to sewer may create fire or explosion hazard. Containers may explode when heated. Many liquids are lighter than water.
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