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Details

Stereochemistry ACHIRAL
Molecular Formula C7H4BrClO2
Molecular Weight 235.462
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Bromo-2-chlorobenzoic acid

SMILES

OC(=O)C1=CC=CC(Br)=C1Cl

InChI

InChIKey=LNURMIDMOXCNEH-UHFFFAOYSA-N
InChI=1S/C7H4BrClO2/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3H,(H,10,11)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
Benzoic acid, 3-bromo-2-chloro-
Preferred Name English
3-Bromo-2-chlorobenzoic acid
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID80275017
Created by admin on Wed Apr 02 20:24:59 GMT 2025 , Edited by admin on Wed Apr 02 20:24:59 GMT 2025
PRIMARY
FDA UNII
US36FB84HE
Created by admin on Wed Apr 02 20:24:59 GMT 2025 , Edited by admin on Wed Apr 02 20:24:59 GMT 2025
PRIMARY
PUBCHEM
33124
Created by admin on Wed Apr 02 20:24:59 GMT 2025 , Edited by admin on Wed Apr 02 20:24:59 GMT 2025
PRIMARY
CAS
56961-27-4
Created by admin on Wed Apr 02 20:24:59 GMT 2025 , Edited by admin on Wed Apr 02 20:24:59 GMT 2025
PRIMARY
NIH
NCATS
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