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Details

Stereochemistry ACHIRAL
Molecular Formula C6H11O4S.Na
Molecular Weight 202.204
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CYCLOHEXANONE SODIUM BISULFITE

SMILES

[Na+].OC1(CCCCC1)S([O-])(=O)=O

InChI

InChIKey=JRZIYJSQQILHNO-UHFFFAOYSA-M
InChI=1S/C6H12O4S.Na/c7-6(11(8,9)10)4-2-1-3-5-6;/h7H,1-5H2,(H,8,9,10);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C6H11O4S
Molecular Weight 179.214
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.9898
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 13:01:02 GMT 2023
Edited
by admin
on Sat Dec 16 13:01:02 GMT 2023
Record UNII
GI6RQO5TGN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CYCLOHEXANONE SODIUM BISULFITE
Systematic Name English
NSC-144183
Code English
CYCLOHEXANESULFONIC ACID, 1-HYDROXY-, MONOSODIUM SALT
Common Name English
Code System Code Type Description
FDA UNII
GI6RQO5TGN
Created by admin on Sat Dec 16 13:01:02 GMT 2023 , Edited by admin on Sat Dec 16 13:01:02 GMT 2023
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NSC
144183
Created by admin on Sat Dec 16 13:01:02 GMT 2023 , Edited by admin on Sat Dec 16 13:01:02 GMT 2023
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PUBCHEM
23672294
Created by admin on Sat Dec 16 13:01:02 GMT 2023 , Edited by admin on Sat Dec 16 13:01:02 GMT 2023
PRIMARY
ECHA (EC/EINECS)
236-804-5
Created by admin on Sat Dec 16 13:01:02 GMT 2023 , Edited by admin on Sat Dec 16 13:01:02 GMT 2023
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EPA CompTox
DTXSID0065511
Created by admin on Sat Dec 16 13:01:02 GMT 2023 , Edited by admin on Sat Dec 16 13:01:02 GMT 2023
PRIMARY
CAS
13489-81-1
Created by admin on Sat Dec 16 13:01:02 GMT 2023 , Edited by admin on Sat Dec 16 13:01:02 GMT 2023
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