4-(Acetylamino)-5-methoxy-2-methylbenzenesulfonyl chloride

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H12ClNO4S
Molecular Weight	277.725
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-(Acetylamino)-5-methoxy-2-methylbenzenesulfonyl chloride

Structure Search

SMILES

COC1=CC(=C(C)C=C1NC(C)=O)S(Cl)(=O)=O

InChI

InChIKey=XWRBAVORXAXIRN-UHFFFAOYSA-N

InChI=1S/C10H12ClNO4S/c1-6-4-8(12-7(2)13)9(16-3)5-10(6)17(11,14)15/h4-5H,1-3H3,(H,12,13)

HIDE SMILES / InChI

Molecular Formula	C10H12ClNO4S
Molecular Weight	277.725
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 20:16:58 GMT 2025` Edited by `admin` on `Tue Apr 01 20:16:58 GMT 2025`
Record UNII	5UV9YN4675
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

4-(Acetylamino)-5-methoxy-2-methylbenzenesulfonyl chloride

Systematic Name

English

Benzenesulfonyl chloride, 4-(acetylamino)-5-methoxy-2-methyl-

Preferred Name

English

4-Acetamido-5-methoxy-2-methylbenzenesulfonyl chloride

Systematic Name

English

Code System Code Type Description

CAS

68039-14-5

Created by admin on Tue Apr 01 20:16:58 GMT 2025 , Edited by admin on Tue Apr 01 20:16:58 GMT 2025

PRIMARY

ECHA (EC/EINECS)

268-233-2

Created by admin on Tue Apr 01 20:16:58 GMT 2025 , Edited by admin on Tue Apr 01 20:16:58 GMT 2025

PRIMARY

EPA CompTox

DTXSID4071007

Created by admin on Tue Apr 01 20:16:58 GMT 2025 , Edited by admin on Tue Apr 01 20:16:58 GMT 2025

PRIMARY

PUBCHEM

106430

Created by admin on Tue Apr 01 20:16:58 GMT 2025 , Edited by admin on Tue Apr 01 20:16:58 GMT 2025

PRIMARY

FDA UNII

5UV9YN4675

Created by admin on Tue Apr 01 20:16:58 GMT 2025 , Edited by admin on Tue Apr 01 20:16:58 GMT 2025

PRIMARY