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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H5Cl3O
Molecular Weight 223.484
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(DICHLOROMETHYL)BENZOYL CHLORIDE

SMILES

ClC(Cl)C1=CC=CC(=C1)C(Cl)=O

InChI

InChIKey=RXYDVDHUAVNAND-UHFFFAOYSA-N
InChI=1S/C8H5Cl3O/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4,7H

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
3-(DICHLOROMETHYL)BENZOYL CHLORIDE
Systematic Name English
.ALPHA.,.ALPHA.-DICHLORO-M-TOLUOYL CHLORIDE
Preferred Name English
BENZOYL CHLORIDE, 3-(DICHLOROMETHYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
IO91DH852P
Created by admin on Mon Mar 31 22:18:33 GMT 2025 , Edited by admin on Mon Mar 31 22:18:33 GMT 2025
PRIMARY
EPA CompTox
DTXSID90369850
Created by admin on Mon Mar 31 22:18:33 GMT 2025 , Edited by admin on Mon Mar 31 22:18:33 GMT 2025
PRIMARY
PUBCHEM
2733325
Created by admin on Mon Mar 31 22:18:33 GMT 2025 , Edited by admin on Mon Mar 31 22:18:33 GMT 2025
PRIMARY
CAS
36747-51-0
Created by admin on Mon Mar 31 22:18:33 GMT 2025 , Edited by admin on Mon Mar 31 22:18:33 GMT 2025
PRIMARY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966