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METHYL PROPIONATE

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Name

METHYL PROPIONATE

EINECS 209-060-4
CAS No. 554-12-1 Density 0.898 g/cm3
PSA 26.30000 LogP 0.56940
Solubility 5 g/100 mL at 20 °C in water Melting Point -88 °C
Formula C4H8O2 Boiling Point 67.9 °C at 760 mmHg
Molecular Weight 88.1063 Flash Point 6.1 °C
Transport Information UN 1248 3/PG 2 Appearance colourless liquid
Safety 16-24-29-33 Risk Codes 11-20
Molecular Structure Molecular Structure of 554-12-1 (Methyl propionate) Hazard Symbols FlammableF, HarmfulXn
Synonyms

Propionicacid, methyl ester (8CI);Methyl propanoate;Methylpropylate;NSC 9375;

Article Data 249

METHYL PROPIONATE Synthetic route

67-56-1

methanol

802294-64-0

propionic acid

554-12-1

propanoic acid methyl ester

Conditions
ConditionsYield
With boron trifluoride at 65℃; for 0.333333h;100%
With Dowex 50W×2 hydrogen form at 103 - 108℃; Reagent/catalyst; Autoclave; Large scale;98.6%
With bis(acetylacetonato)dioxidomolybdenum(VI) for 8h; Heating;72%
292638-85-8

acrylic acid methyl ester

554-12-1

propanoic acid methyl ester

Conditions
ConditionsYield
With hydrogen; palladium(II) complex of ferrocenylamine sulfide (2) In acetone under 4137.2 Torr; for 0.25h; or with catalyst 3, 0.75 h;100%
With [Ir(1-(1′-methylpyrazole)-3-(4′-methylphenyl)triazenide)Cp*Cl]; isopropyl alcohol at 90℃; for 6h; Catalytic behavior; Reagent/catalyst; Inert atmosphere; Glovebox;99%
With tetrahydroxydiboron; water; sodium hydrogencarbonate In tetrahydrofuran at 60℃; for 8h; Inert atmosphere;99%
74-85-1

ethene

[PdH(PPh3)3](TsO)

201230-82-2

carbon monoxide

771476-64-3

trans-[Pd(COEt)(OTs)(PPh3)2]

B

554-12-1

propanoic acid methyl ester

1478674-03-1

[Pd(COEt)(PPh3)3](TsO)

Conditions
ConditionsYield
at -80.16 - 49.84℃; under 3000.3 Torr; for 0.0133333h;A 0.1%
B 100%
C n/a
67-56-1

methanol

74-85-1

ethene

201230-82-2

carbon monoxide

554-12-1

propanoic acid methyl ester

Conditions
ConditionsYield
With methanesulfonic acid; palladium diacetate; bis(phosphaadamantyl)diphosphine at 90℃;99%
With α,α′-bis(2-pyridyl(tert-butyl)phosphino)-o-xylene; palladium dichloride at 80℃; under 15001.5 - 22502.3 Torr; for 20h; Reagent/catalyst; Pressure; Inert atmosphere; Autoclave;99%
With bis(acetylacetonato)palladium(II); 1,1’-ferrocenediyl-bis(tert-butyl(pyridin-2-yl)phosphine); toluene-4-sulfonic acid at 80℃; for 0.166667h; Catalytic behavior; Reagent/catalyst; Temperature; Autoclave; Inert atmosphere;99%
67-56-1

methanol

771476-64-3

trans-[Pd(COEt)(OTs)(PPh3)2]

201230-82-2

carbon monoxide

771476-65-4

trans-[Pd(COOMe)(OTs)(PPh3)2]

B

554-12-1

propanoic acid methyl ester

Conditions
ConditionsYield
With toluene-4-sulfonic acid; triphenylphosphine In methanol Pd complex, (0.1 mmol) reacted with MeOH containing PPh3 (0.1 mmol) + p-toluenesulfonic acid (0.1 mmol) satd. with CO (ca. 20 min); pptd. with cold H2O; suspn. filtered; ppt. washed with cold H2O; dried (vac.);A 90%
B 99%
67-56-1

methanol

50-00-0

formaldehyd

74-85-1

ethene

554-12-1

propanoic acid methyl ester

Conditions
ConditionsYield
With palladium diacetate; toluene-4-sulfonic acid; 1,2-bis[di(t-butyl)phosphinomethyl]benzene at 100℃; under 3750.38 Torr; for 20h; Inert atmosphere; Autoclave; regioselective reaction;99%
802294-64-0

propionic acid

616-38-6

carbonic acid dimethyl ester

554-12-1

propanoic acid methyl ester

Conditions
ConditionsYield
With triethylamine at 160℃; for 5h; Autoclave; Green chemistry;98%
With diiron nonacarbonyl at 180℃; for 1h; Sealed tube;
922-67-8

propynoic acid methyl ester

554-12-1

propanoic acid methyl ester

Conditions
ConditionsYield
With tetrahydroxydiboron; water; sodium hydrogencarbonate In methanol at 80℃; for 12h;98%
67-56-1

methanol

40424-08-6

1,1'-(2-oxoimidazolidine-1,3-diyl)bis(propan-1-one)

A

120-93-4

imidazolidone

B

554-12-1

propanoic acid methyl ester

Conditions
ConditionsYield
With C17H23BN2O at 50℃; under 760.051 Torr; for 15h; Inert atmosphere; chemoselective reaction;A 97%
B n/a
67-56-1

methanol

40424-08-6

1,1'-(2-oxoimidazolidine-1,3-diyl)bis(propan-1-one)

A

554-12-1

propanoic acid methyl ester

B

55150-33-9

1-propionyl-2-oxo-imidazolidine

Conditions
ConditionsYield
With C17H23BN2O at 25℃; under 760.051 Torr; for 0.25h; Inert atmosphere; chemoselective reaction;A n/a
B 96%

METHYL PROPIONATE Chemical Properties

   The molecular formula of METHYL PROPIONATE(554-12-1) is C4H8O2 and its formula weight is 88.12g/mol.The appearance of METHYL PROPIONATE(554-12-1) is colourless and ruit flavor liquid.Its EINECS is 209-060-4.Its liansport information is UN 1248.The density of METHYL PROPIONATE(554-12-1) is 0.915 g/mL at 25 °C(lit.) and it has a melting point of  -88 °C .The boiling point is 79 °C(lit.).The refractive index is about n20/D 1.376(lit.) and molar refractivity is 22.35 cm3.Its flash point is 43 °F and the vapor pressure is 40 mm Hg ( 11 °C).Molar volume is 98 cm3 and polarizability is 8.86 10-24cm3.Surface tension is 23.5 dyne/cm and enthalpy of vaporization is 32.24 kJ/mol.METHYL PROPIONATE(554-12-1) has the property of being dissolved in alcohols, ethers, hydrocarbons and other organic solvents, slightly soluble in water. The solubility of METHYL PROPIONATE(554-12-1) is 5 g/100 mL at 20 °C in water.
   The chemical synonyms of METHYL PROPIONATE(554-12-1) are C2H5COOCH3;femanumber2742;Methyl ester of propanoic acid;Methylester kyseliny propionove;methylesterkyselinypropionove;Propionate de methyle;propionatedemethyle and propionatedemethyle(french).Its product categories is Organics;Analytical Chemistry;Fatty Acid Methyl Esters (GC Standard);Standard Materials for GC;FAMEs;Fatty AcidsAlphabetic;Lipid Analytical Standards;M;META - METHSaturated fatty acids and derivatives;Methyl EstersFA/FAME/Lipids/Steroids;Neats&Single Component Solutions;Other Lipid Related Products;C2 to C5Saturated fatty acids and derivatives;Carbonyl Compounds;Esters;Methyl Esters;Alphabetical Listings;Flavors and Fragrances and M-N. The molecular structure of METHYL PROPIONATE(554-12-1) is .

METHYL PROPIONATE Uses

It can be used in  medicine, pesticides and intermediates of  perfume .

METHYL PROPIONATE Production

It is derived from the esterification of propionic acid with methanol :                                                                 CH3CH2COOH + CH3OH → CH3CH2COOCH3 + H2O

METHYL PROPIONATE Toxicity Data With Reference

1.   

skn-rbt 500 mg/24H MOD

   FCTOD7    Food and Chemical Toxicology. 20 (Suppl)(1982),765.
2.   

orl-rat LD50:5 g/kg

   FCTOD7    Food and Chemical Toxicology. 20 (Suppl)(1982),765.
3.   

orl-mus LD50:3460 mg/kg

   GTPZAB    Gigiena Truda i Professionalnye Zabolevaniia. Labor Hygiene and Occupational Diseases. 18 (3)(1974),48.
4.   

ihl-mus LC50:27 g/m3

   GTPZAB    Gigiena Truda i Professionalnye Zabolevaniia. Labor Hygiene and Occupational Diseases. 18 (3)(1974),48.
5.   

orl-rbt LDLo:2550 mg/kg

   AMIHAB    AMA Archives of Industrial Health. 21 (1960),100.

METHYL PROPIONATE Consensus Reports

Reported in EPA TSCA Inventory.

METHYL PROPIONATE Safety Profile

Moderately toxic by ingestion. Mildly toxic by inhalation. A skin irritant. A very dangerous fire hazard when exposed to heat, flame, or oxidizers. Explosive in the form of vapor when exposed to heat or flame. To fight fire, use foam, CO2, dry chemical. When heated to decomposition it emits acrid smoke and irritating fumes. It is flammable, dangerous fire risk, explosive limits in air 2.5–13%. Hazard codes is F,Xn . Risk codes is R11;R20. Safety description is S16;S24;S29;S33.

METHYL PROPIONATE Standards and Recommendations

DOT Classification:  3; Label: Flammable Liquid

METHYL PROPIONATE Specification

Its extinguishing agents is dry powder, dry sand, carbon dioxide, foam and 1211  extinguishing agent.
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