3-(1-CYANOETHYL)BENZOIC ACID

Details

Stereochemistry	RACEMIC
Molecular Formula	C10H9NO2
Molecular Weight	175.184
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-(1-CYANOETHYL)BENZOIC ACID

Structure Search

SMILES

CC(C#N)C1=CC(=CC=C1)C(O)=O

InChI

InChIKey=IRYIYPWRXROPSX-UHFFFAOYSA-N

InChI=1S/C10H9NO2/c1-7(6-11)8-3-2-4-9(5-8)10(12)13/h2-5,7H,1H3,(H,12,13)

HIDE SMILES / InChI

Molecular Formula	C10H9NO2
Molecular Weight	175.184
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:57:28 GMT 2025` Edited by `admin` on `Mon Mar 31 22:57:28 GMT 2025`
Record UNII	3PN2M0G40N
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-(1-CYANOETHYL)BENZOIC ACID

Systematic Name

English

DF-2107Y

Preferred Name

English

M-(1-CYANOETHYL)BENZOIC ACID

Systematic Name

English

BENZOIC ACID, 3-(1-CYANOETHYL)-

Systematic Name

English

2-(3-CARBOXYPHENYL)PROPIONITRILE

Systematic Name

English

NSC-113992

Code

English

3-((1RS)-1-CYANOETHYL)BENZOIC ACID

Systematic Name

English

(±)-3-(1-CYANOETHYL)BENZOIC ACID

Systematic Name

English

KETOPROFEN IMPURITY G [EP IMPURITY]

Common Name

English

Code System Code Type Description

ECHA (EC/EINECS)

226-897-0