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

Details

Stereochemistry ACHIRAL
Molecular Formula C6H6ClNO4S
Molecular Weight 223.634
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-AMINO-5-CHLORO-2-HYDROXYBENZENESULFONIC ACID

SMILES

NC1=CC(Cl)=CC(=C1O)S(O)(=O)=O

InChI

InChIKey=YCTAOQGPWNTYJE-UHFFFAOYSA-N
InChI=1S/C6H6ClNO4S/c7-3-1-4(8)6(9)5(2-3)13(10,11)12/h1-2,9H,8H2,(H,10,11,12)

HIDE SMILES / InChI

Molecular Formula C6H6ClNO4S
Molecular Weight 223.634
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 Fri Dec 15 17:27:36 GMT 2023
Edited
by admin
on Fri Dec 15 17:27:36 GMT 2023
Record UNII
83IP35P6EZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-AMINO-5-CHLORO-2-HYDROXYBENZENESULFONIC ACID
Systematic Name English
5-CHLORO-2-HYDROXYMETANILIC ACID
Common Name English
AMINO-4-CHLORO-1-PHENOL-2-SULFONIC ACID, 6-
Common Name English
1-PHENOL-2-SULFONIC ACID, 6-AMINO-4-CHLORO-
Systematic Name English
6-AMINO-4-CHLOROPHENOL-2-SULFONIC ACID
Common Name English
4-CHLORO-2-AMINOPHENOL-6-SULFONIC ACID
Common Name English
BENZENESULFONIC ACID, 3-AMINO-5-CHLORO-2-HYDROXY-
Systematic Name English
6-AMINO-4-CHLORO-1-PHENOL-2-SULFONIC ACID
Common Name English
2-AMINO-4-CHLOROPHENOL-6-SULFONIC ACID
Common Name English
NSC-7539
Code English
2-AMINO-4-CHLORO-6-SULFOPHENOL
Systematic Name English
METANILIC ACID, 5-CHLORO-2-HYDROXY-
Systematic Name English
2-HYDROXY-3-AMINO-5-CHLOROBENZENESULFONIC ACID
Systematic Name English
1-AMINO-5-CHLORO-2-HYDROXY-3-BENZENESULFONIC ACID
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID0024474
Created by admin on Fri Dec 15 17:27:36 GMT 2023 , Edited by admin on Fri Dec 15 17:27:36 GMT 2023
PRIMARY
CAS
88-23-3
Created by admin on Fri Dec 15 17:27:36 GMT 2023 , Edited by admin on Fri Dec 15 17:27:36 GMT 2023
PRIMARY
NSC
7539
Created by admin on Fri Dec 15 17:27:36 GMT 2023 , Edited by admin on Fri Dec 15 17:27:36 GMT 2023
PRIMARY
PUBCHEM
6927
Created by admin on Fri Dec 15 17:27:36 GMT 2023 , Edited by admin on Fri Dec 15 17:27:36 GMT 2023
PRIMARY
ECHA (EC/EINECS)
201-813-5
Created by admin on Fri Dec 15 17:27:36 GMT 2023 , Edited by admin on Fri Dec 15 17:27:36 GMT 2023
PRIMARY
FDA UNII
83IP35P6EZ
Created by admin on Fri Dec 15 17:27:36 GMT 2023 , Edited by admin on Fri Dec 15 17:27:36 GMT 2023
PRIMARY