4-COUMARIC ACID METHYL ESTER

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H10O3
Molecular Weight	178.1846
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 4-COUMARIC ACID METHYL ESTER

Structure Search

SMILES

COC(=O)C=CC1=CC=C(O)C=C1

InChI

InChIKey=NITWSHWHQAQBAW-UHFFFAOYSA-N

InChI=1S/C10H10O3/c1-13-10(12)7-4-8-2-5-9(11)6-3-8/h2-7,11H,1H3

HIDE SMILES / InChI

Molecular Formula	C10H10O3
Molecular Weight	178.1846
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:45:10 GMT 2023` Edited by `admin` on `Fri Dec 15 17:45:10 GMT 2023`
Record UNII	P9G2H2437D
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-COUMARIC ACID METHYL ESTER

Systematic Name

English

METHYL 4-COUMARATE

Systematic Name

English

P-HYDROXYCINNAMIC ACID METHYL ESTER

Systematic Name

English

2-PROPENOIC ACID, 3-(4-HYDROXYPHENYL)-, METHYL ESTER

Systematic Name

English

METHYL 4-HYDROXYCINNAMATE

Systematic Name

English

3-(4-HYDROXYPHENYL)-2-PROPENOIC ACID METHYL ESTER

Systematic Name

English

NSC-154578

Code

English

P-COUMARIC ACID METHYL ESTER

Systematic Name

English

4-HYDROXYCINNAMIC ACID METHYL ESTER

Systematic Name

English

METHYL 3-(4-HYDROXYPHENYL)ACRYLATE

Systematic Name

English

METHYL P-COUMARATE

Systematic Name

English

Code System Code Type Description

FDA UNII

P9G2H2437D

Created by admin on Fri Dec 15 17:45:11 GMT 2023 , Edited by admin on Fri Dec 15 17:45:11 GMT 2023

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EPA CompTox

DTXSID101315877

Created by admin on Fri Dec 15 17:45:11 GMT 2023 , Edited by admin on Fri Dec 15 17:45:11 GMT 2023

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CHEBI

86904

Created by admin on Fri Dec 15 17:45:10 GMT 2023 , Edited by admin on Fri Dec 15 17:45:10 GMT 2023

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ECHA (EC/EINECS)

223-531-1

Created by admin on Fri Dec 15 17:45:10 GMT 2023 , Edited by admin on Fri Dec 15 17:45:10 GMT 2023

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CAS

3943-97-3

Created by admin on Fri Dec 15 17:45:10 GMT 2023 , Edited by admin on Fri Dec 15 17:45:10 GMT 2023

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NSC

154578

Created by admin on Fri Dec 15 17:45:11 GMT 2023 , Edited by admin on Fri Dec 15 17:45:11 GMT 2023

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PUBCHEM

92203

Created by admin on Fri Dec 15 17:45:11 GMT 2023 , Edited by admin on Fri Dec 15 17:45:11 GMT 2023

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