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Details

Stereochemistry ACHIRAL
Molecular Formula C8H7ClNO4S.Na
Molecular Weight 271.653
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Sodium 2-acetamido-5-chlorobenzenesulfonate

SMILES

[Na+].CC(=O)NC1=C(C=C(Cl)C=C1)S([O-])(=O)=O

InChI

InChIKey=GFUFZPFKKASMNJ-UHFFFAOYSA-M
InChI=1S/C8H8ClNO4S.Na/c1-5(11)10-7-3-2-6(9)4-8(7)15(12,13)14;/h2-4H,1H3,(H,10,11)(H,12,13,14);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C8H7ClNO4S
Molecular Weight 248.663
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.98976928
Charge 1
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 17:01:51 GMT 2025
Edited
by admin
on Tue Apr 01 17:01:51 GMT 2025
Record UNII
PJG6493GC2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzenesulfonic acid, 2-(acetylamino)-5-chloro-, sodium salt
Preferred Name English
Sodium 2-acetamido-5-chlorobenzenesulfonate
Systematic Name English
Code System Code Type Description
PUBCHEM
23662520
Created by admin on Tue Apr 01 17:01:51 GMT 2025 , Edited by admin on Tue Apr 01 17:01:51 GMT 2025
PRIMARY
EPA CompTox
DTXSID80234023
Created by admin on Tue Apr 01 17:01:51 GMT 2025 , Edited by admin on Tue Apr 01 17:01:51 GMT 2025
PRIMARY
FDA UNII
PJG6493GC2
Created by admin on Tue Apr 01 17:01:51 GMT 2025 , Edited by admin on Tue Apr 01 17:01:51 GMT 2025
PRIMARY
CAS
84963-38-2
Created by admin on Tue Apr 01 17:01:51 GMT 2025 , Edited by admin on Tue Apr 01 17:01:51 GMT 2025
PRIMARY
ECHA (EC/EINECS)
284-841-0
Created by admin on Tue Apr 01 17:01:51 GMT 2025 , Edited by admin on Tue Apr 01 17:01:51 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE