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3-Phenylpropionic acid methyl ester

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3-Phenylpropionic acid methyl ester Basic information

Product Name:
3-Phenylpropionic acid methyl ester
Synonyms:
  • Benzenepropanoic acid, methyl ester
  • benzenepropanoicacid,methylester
  • beta-Phenylpropionic acid methyl ester
  • Hydrocinnamic acid, methyl ester
  • methyl (3-phenyI) propanoate
  • Methyl 3-phenylpropanoate
  • Methyl benzenepropanoate
  • Methyl beta-phenylpropionate
CAS:
103-25-3
MF:
C10H12O2
MW:
164.2
EINECS:
203-092-2
Product Categories:
  • Pharmaceutical Intermediates
  • Aromatic Cinnamic Acids, Esters and Derivatives
  • Organic acids
  • 103-25-3
  • 11
Mol File:
103-25-3.mol
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3-Phenylpropionic acid methyl ester Chemical Properties

Melting point:
142-145 °C
Boiling point:
91-92 °C4 mm Hg(lit.)
Density 
1.043 g/mL at 25 °C(lit.)
refractive index 
n20/D 1.502(lit.)
FEMA 
2741 | METHYL 3-PHENYLPROPIONATE
Flash point:
212 °F
storage temp. 
Sealed in dry,Room Temperature
solubility 
Chloroform (Slightly), Methanol (Slightly)
form 
Oil
color 
Colourless to Pale Yellow
Odor
at 100.00 %. honey fruity wine balsam floral
Odor Type
honey
Water Solubility 
Soluble in chloroform. Insoluble in water.
JECFA Number
643
BRN 
1909591
InChIKey
RPUSRLKKXPQSGP-UHFFFAOYSA-N
LogP
2.26
CAS DataBase Reference
103-25-3(CAS DataBase Reference)
NIST Chemistry Reference
3-Phenylpropanoic acid methyl ester(103-25-3)
EPA Substance Registry System
Benzenepropanoic acid, methyl ester (103-25-3)
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Safety Information

Safety Statements 
24/25
WGK Germany 
2
TSCA 
Yes
HS Code 
29163990

MSDS

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3-Phenylpropionic acid methyl ester Usage And Synthesis

Description

Methyl 3-phenylpropionate has a strong floral-fruity odor. May be prepared by reduction of methyl cinnamate in methanol solution with hydrogen and Ni under pressure.

Chemical Properties

Methyl-3-phenylpropionate has a strong floral–fruity odor, with honey and wine-like undertones

Chemical Properties

Clear light yellow liquid

Occurrence

Reported found in tabasco peppers, grapes, rhubarb, soursop and basil

Uses

Methyl 3-phenylpropionate, is used as an important raw material and intermediate used in organic Synthesis, pharmaceuticals, agrochemicals and dyestuff. 3-Phenylpropionic Acid Methyl Ester is an ester derivative of 3-phenylpropionic acid that is sometimes present in fragrance ingredients. It is also used as an application, aromatic intermediate.

Definition

ChEBI: Methyl 3-phenylpropanoate is a methyl ester resulting from the formal condensation of the carboxy group of 3-phenylpropionic acid with methanol. It has a role as a volatile oil component, a flavouring agent and a human metabolite. It is a methyl ester and a member of benzenes. It is functionally related to a 3-phenylpropionic acid.

Preparation

By reduction of methyl cinnamate in methanol solution with hydrogen and Ni under pressure

Aroma threshold values

Aroma characteristics at 1.0%: sweet, rich spicy Ceylon cinnamonlike, balsamic with fruity, resinous and powdery nuances

Taste threshold values

Taste characteristics at 5 ppm: cinnamon spicy, sweet, balsamic with fruity floral and resinous nuances.

Synthesis Reference(s)

Tetrahedron Letters, 30, p. 5293, 1989 DOI: 10.1016/S0040-4039(01)93768-2
Journal of the American Chemical Society, 95, p. 625, 1973 DOI: 10.1021/ja00783a073

3-Phenylpropionic acid methyl ester Preparation Products And Raw materials

Preparation Products

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