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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H5ClO4S
Molecular Weight 220.63
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(CHLOROSULFONYL)BENZOIC ACID

SMILES

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

InChI

InChIKey=PTCSSXYPZOFISK-UHFFFAOYSA-N
InChI=1S/C7H5ClO4S/c8-13(11,12)6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)

HIDE SMILES / InChI

Molecular Formula C7H5ClO4S
Molecular Weight 220.63
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 Sat Dec 16 11:57:03 GMT 2023
Edited
by admin
on Sat Dec 16 11:57:03 GMT 2023
Record UNII
SW7ZBW2FWE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(CHLOROSULFONYL)BENZOIC ACID
Systematic Name English
P-CARBOXYBENZENESULFONYL CHLORIDE
Systematic Name English
4-CARBOXYPHENYLSULFONYL CHLORIDE
Systematic Name English
BENZOIC ACID, 4-(CHLOROSULFONYL)-
Common Name English
4-CARBOXYBENZENESULFONYL CHLORIDE
Systematic Name English
P-(CHLOROSULFONYL)BENZOIC ACID
Systematic Name English
NSC-191087
Code English
Code System Code Type Description
ECHA (EC/EINECS)
233-367-2
Created by admin on Sat Dec 16 11:57:03 GMT 2023 , Edited by admin on Sat Dec 16 11:57:03 GMT 2023
PRIMARY
FDA UNII
SW7ZBW2FWE
Created by admin on Sat Dec 16 11:57:03 GMT 2023 , Edited by admin on Sat Dec 16 11:57:03 GMT 2023
PRIMARY
CAS
10130-89-9
Created by admin on Sat Dec 16 11:57:03 GMT 2023 , Edited by admin on Sat Dec 16 11:57:03 GMT 2023
PRIMARY
EPA CompTox
DTXSID5064960
Created by admin on Sat Dec 16 11:57:03 GMT 2023 , Edited by admin on Sat Dec 16 11:57:03 GMT 2023
PRIMARY
PUBCHEM
82385
Created by admin on Sat Dec 16 11:57:03 GMT 2023 , Edited by admin on Sat Dec 16 11:57:03 GMT 2023
PRIMARY
NSC
191087
Created by admin on Sat Dec 16 11:57:03 GMT 2023 , Edited by admin on Sat Dec 16 11:57:03 GMT 2023
PRIMARY