U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C9H9ClO
Molecular Weight 168.62
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,6-DIMETHYLBENZOYL CHLORIDE

SMILES

CC1=CC=CC(C)=C1C(Cl)=O

InChI

InChIKey=CFLAYISSADVCJH-UHFFFAOYSA-N
InChI=1S/C9H9ClO/c1-6-4-3-5-7(2)8(6)9(10)11/h3-5H,1-2H3

HIDE SMILES / InChI

Approval Year

Name Type Language
BENZOYL CHLORIDE, 2,6-DIMETHYL-
Preferred Name English
2,6-DIMETHYLBENZOYL CHLORIDE
Systematic Name English
Code System Code Type Description
FDA UNII
WQM56Y8NEQ
Created by admin on Tue Apr 01 20:26:55 GMT 2025 , Edited by admin on Tue Apr 01 20:26:55 GMT 2025
PRIMARY
CAS
21900-37-8
Created by admin on Tue Apr 01 20:26:55 GMT 2025 , Edited by admin on Tue Apr 01 20:26:55 GMT 2025
PRIMARY
ECHA (EC/EINECS)
244-646-3
Created by admin on Tue Apr 01 20:26:55 GMT 2025 , Edited by admin on Tue Apr 01 20:26:55 GMT 2025
PRIMARY
EPA CompTox
DTXSID20176312
Created by admin on Tue Apr 01 20:26:55 GMT 2025 , Edited by admin on Tue Apr 01 20:26:55 GMT 2025
PRIMARY
PUBCHEM
89096
Created by admin on Tue Apr 01 20:26:55 GMT 2025 , Edited by admin on Tue Apr 01 20:26:55 GMT 2025
PRIMARY