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Details

Stereochemistry ACHIRAL
Molecular Formula C6H3ClNO5S.K
Molecular Weight 275.708
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Potassium 4-chloro-3-nitrobenzenesulfonate

SMILES

[K+].[O-][N+](=O)C1=CC(=CC=C1Cl)S([O-])(=O)=O

InChI

InChIKey=LOEIXPJQKVLCSA-UHFFFAOYSA-M
InChI=1S/C6H4ClNO5S.K/c7-5-2-1-4(14(11,12)13)3-6(5)8(9)10;/h1-3H,(H,11,12,13);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula K
Molecular Weight 39.0983
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C6H3ClNO5S
Molecular Weight 236.61
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 Sat Dec 16 11:56:54 GMT 2023
Edited
by admin
on Sat Dec 16 11:56:54 GMT 2023
Record UNII
6G9RA7KHZ3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Potassium 4-chloro-3-nitrobenzenesulfonate
Systematic Name English
Benzenesulfonic acid, 4-chloro-3-nitro-, potassium salt (1:1)
Common Name English
BENZENESULFONIC ACID, 4-CHLORO-3-NITRO-, POTASSIUM SALT
Common Name English
NSC-202712
Code English
Potassium 1-chloro-2-nitrobenzene-4-sulfonate
Systematic Name English
Code System Code Type Description
FDA UNII
6G9RA7KHZ3
Created by admin on Sat Dec 16 11:56:54 GMT 2023 , Edited by admin on Sat Dec 16 11:56:54 GMT 2023
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CAS
6671-49-4
Created by admin on Sat Dec 16 11:56:54 GMT 2023 , Edited by admin on Sat Dec 16 11:56:54 GMT 2023
PRIMARY
EPA CompTox
DTXSID7064449
Created by admin on Sat Dec 16 11:56:54 GMT 2023 , Edited by admin on Sat Dec 16 11:56:54 GMT 2023
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PUBCHEM
81181
Created by admin on Sat Dec 16 11:56:54 GMT 2023 , Edited by admin on Sat Dec 16 11:56:54 GMT 2023
PRIMARY
ECHA (EC/EINECS)
229-709-5
Created by admin on Sat Dec 16 11:56:54 GMT 2023 , Edited by admin on Sat Dec 16 11:56:54 GMT 2023
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NSC
202712
Created by admin on Sat Dec 16 11:56:54 GMT 2023 , Edited by admin on Sat Dec 16 11:56:54 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE