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Details

Stereochemistry ACHIRAL
Molecular Formula C7H5ClO5S
Molecular Weight 236.63
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Chloro-3-sulfobenzoic acid

SMILES

OC(=O)C1=CC(=C(Cl)C=C1)S(O)(=O)=O

InChI

InChIKey=WKRRNYRCYXPKBD-UHFFFAOYSA-N
InChI=1S/C7H5ClO5S/c8-5-2-1-4(7(9)10)3-6(5)14(11,12)13/h1-3H,(H,9,10)(H,11,12,13)

HIDE SMILES / InChI

Molecular Formula C7H5ClO5S
Molecular Weight 236.63
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 Wed Apr 02 21:08:35 GMT 2025
Edited
by admin
on Wed Apr 02 21:08:35 GMT 2025
Record UNII
GKA3WB4NT4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzoic acid, 4-chloro-3-sulfo-
Preferred Name English
4-Chloro-3-sulfobenzoic acid
Systematic Name English
Code System Code Type Description
CAS
755698-62-5
Created by admin on Wed Apr 02 21:08:35 GMT 2025 , Edited by admin on Wed Apr 02 21:08:35 GMT 2025
PRIMARY
PUBCHEM
20390322
Created by admin on Wed Apr 02 21:08:35 GMT 2025 , Edited by admin on Wed Apr 02 21:08:35 GMT 2025
PRIMARY
FDA UNII
GKA3WB4NT4
Created by admin on Wed Apr 02 21:08:35 GMT 2025 , Edited by admin on Wed Apr 02 21:08:35 GMT 2025
PRIMARY