2,3-DIMETHYLBENZONITRILE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H9N
Molecular Weight	131.1745
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,3-DIMETHYLBENZONITRILE

Structure Search

SMILES

CC1=C(C)C(=CC=C1)C#N

InChI

InChIKey=ZEDPQIJYJCPIRM-UHFFFAOYSA-N

InChI=1S/C9H9N/c1-7-4-3-5-9(6-10)8(7)2/h3-5H,1-2H3

HIDE SMILES / InChI

Molecular Formula	C9H9N
Molecular Weight	131.1745
Charge	0
Count

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

Approval Year

Patents

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:45:09 GMT 2025` Edited by `admin` on `Mon Mar 31 19:45:09 GMT 2025`
Record UNII	6S215F38OK
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

BENZONITRILE, 2,3-DIMETHYL-

Preferred Name

English

2,3-DIMETHYLBENZONITRILE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID80205854

Created by admin on Mon Mar 31 19:45:09 GMT 2025 , Edited by admin on Mon Mar 31 19:45:09 GMT 2025

PRIMARY

ECHA (EC/EINECS)

227-229-0

Created by admin on Mon Mar 31 19:45:09 GMT 2025 , Edited by admin on Mon Mar 31 19:45:09 GMT 2025

PRIMARY

CAS

5724-56-1

Created by admin on Mon Mar 31 19:45:09 GMT 2025 , Edited by admin on Mon Mar 31 19:45:09 GMT 2025

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PUBCHEM

79802

Created by admin on Mon Mar 31 19:45:09 GMT 2025 , Edited by admin on Mon Mar 31 19:45:09 GMT 2025

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FDA UNII

6S215F38OK

Created by admin on Mon Mar 31 19:45:09 GMT 2025 , Edited by admin on Mon Mar 31 19:45:09 GMT 2025

PRIMARY