BENZYL ISOCROTONATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H12O2
Molecular Weight	176.2118
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C\C=C/C(=O)OCC1=CC=CC=C1

InChI

InChIKey=NCPTYZLUYHXITE-KXFIGUGUSA-N

InChI=1S/C11H12O2/c1-2-6-11(12)13-9-10-7-4-3-5-8-10/h2-8H,9H2,1H3/b6-2-

HIDE SMILES / InChI

Molecular Formula	C11H12O2
Molecular Weight	176.2118
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 `Mon Mar 31 21:24:05 GMT 2025` Edited by `admin` on `Mon Mar 31 21:24:05 GMT 2025`
Record UNII	FM79KZL3BZ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISOCROTONIC ACID BENZYL ESTER

Preferred Name

English

BENZYL ISOCROTONATE

Systematic Name

English

2-BUTENOIC ACID, PHENYLMETHYL ESTER, (Z)-

Common Name

English

ISOCROTONIC ACID, BENZYL ESTER

Common Name

English

BENZYL CROTONATE, (Z)-

Systematic Name

English

ISOCROTONIC ACID BENZYL ESTER [MI]

Common Name

English

Code System Code Type Description

MERCK INDEX

m6479

Created by admin on Mon Mar 31 21:24:05 GMT 2025 , Edited by admin on Mon Mar 31 21:24:05 GMT 2025

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Merck Index

FDA UNII

FM79KZL3BZ

Created by admin on Mon Mar 31 21:24:05 GMT 2025 , Edited by admin on Mon Mar 31 21:24:05 GMT 2025

PRIMARY

CAS

92758-75-3

Created by admin on Mon Mar 31 21:24:05 GMT 2025 , Edited by admin on Mon Mar 31 21:24:05 GMT 2025

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PUBCHEM

57731298

Created by admin on Mon Mar 31 21:24:05 GMT 2025 , Edited by admin on Mon Mar 31 21:24:05 GMT 2025

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