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Methyl p-coumarate

Methyl p-coumarate structure

Methyl p-coumarate 

structure
  • CAS No:

    3943-97-3

  • Formula:

    C10H10O3

  • Chemical Name:

    Methyl p-coumarate

  • Synonyms:

    2-Propenoic acid,3-(4-hydroxyphenyl)-,methyl ester;Cinnamic acid,p-hydroxy-,methyl ester;Methyl p-hydroxycinnamate;Methyl p-coumarate;Methyl 4-hydroxycinnamate;4-Hydroxycinnamic acid methyl ester;p-Hydroxycinnamic acid methyl ester;p-Coumaric acid methyl ester;Methyl 4-coumarate;3-(4-Hydroxyphenyl)-2-propenoic acid methyl ester;NSC 154578;Methyl 3-(4-hydroxyphenyl)acrylate

  • Categories:

    Flavors and Fragrances  >  Synthetic Fragrances

Methyl p-coumarate Basic Attributes

178.18

178.18

223-531-1

P9G2H2437D

2918290000

Characteristics

46.5

2.3

1.2±0.1 g/cm3

139-140 °C

306.6ºC at 760mmHg

132.8±13.7 °C

1.593

Safety Information

IRRITANT

P261, P272, P273, P280, P302+P352, P321, P333+P313, P363, P501

H317

|Warning|H315 (16.67%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P272, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 6 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

4-coumaric acid methyl ester

Computed Properties

Molecular Weight:178.18
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:178.062994177
Monoisotopic Mass:178.062994177
Topological Polar Surface Area:46.5
Heavy Atom Count:13
Complexity:190
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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