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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H3BrClFO
Molecular Weight 237.454
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Bromo-4-fluorobenzoyl chloride

SMILES

FC1=CC=C(C=C1Br)C(Cl)=O

InChI

InChIKey=HPHZOCIBMCWXCQ-UHFFFAOYSA-N
InChI=1S/C7H3BrClFO/c8-5-3-4(7(9)11)1-2-6(5)10/h1-3H

HIDE SMILES / InChI

Molecular Formula C7H3BrClFO
Molecular Weight 237.454
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 17:46:46 GMT 2025
Edited
by admin
on Tue Apr 01 17:46:46 GMT 2025
Record UNII
42SK58ALG6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzoyl chloride, 3-bromo-4-fluoro-
Preferred Name English
3-Bromo-4-fluorobenzoyl chloride
Systematic Name English
Code System Code Type Description
PUBCHEM
69598
Created by admin on Tue Apr 01 17:46:46 GMT 2025 , Edited by admin on Tue Apr 01 17:46:46 GMT 2025
PRIMARY
ECHA (EC/EINECS)
211-596-9
Created by admin on Tue Apr 01 17:46:46 GMT 2025 , Edited by admin on Tue Apr 01 17:46:46 GMT 2025
PRIMARY
EPA CompTox
DTXSID90217483
Created by admin on Tue Apr 01 17:46:46 GMT 2025 , Edited by admin on Tue Apr 01 17:46:46 GMT 2025
PRIMARY
FDA UNII
42SK58ALG6
Created by admin on Tue Apr 01 17:46:46 GMT 2025 , Edited by admin on Tue Apr 01 17:46:46 GMT 2025
PRIMARY
CAS
672-75-3
Created by admin on Tue Apr 01 17:46:46 GMT 2025 , Edited by admin on Tue Apr 01 17:46:46 GMT 2025
PRIMARY