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Details

Stereochemistry ACHIRAL
Molecular Formula C6H3N2O4.Na
Molecular Weight 190.0888
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of 5-Cyclohexene-1,2,3,4-tetrone, 1,3-dioxime, sodium salt

SMILES

[Na+].O\N=C1\C=CC(=O)\C(=N/[O-])C1=O

InChI

InChIKey=AJIDYBCHZMTJDA-JPLGHBAPSA-M
InChI=1S/C6H4N2O4.Na/c9-4-2-1-3(7-11)6(10)5(4)8-12;/h1-2,11-12H;/q;+1/p-1/b7-3-,8-5+;

HIDE SMILES / InChI

Molecular Formula C6H3N2O4
Molecular Weight 167.099
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
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 19:59:27 GMT 2023
Edited
by admin
on Sat Dec 16 19:59:27 GMT 2023
Record UNII
VX2PU5FWF8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-Cyclohexene-1,2,3,4-tetrone, 1,3-dioxime, sodium salt
Systematic Name English
5-Cyclohexene-1,2,3,4-tetrone, 1,3-dioxime, sodium salt (1:1)
Systematic Name English
5-Cyclohexene-1,2,3,4-tetrone, 1,3-dioxime, monosodium salt
Common Name English
Code System Code Type Description
CAS
68083-36-3
Created by admin on Sat Dec 16 19:59:27 GMT 2023 , Edited by admin on Sat Dec 16 19:59:27 GMT 2023
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ECHA (EC/EINECS)
268-384-4
Created by admin on Sat Dec 16 19:59:27 GMT 2023 , Edited by admin on Sat Dec 16 19:59:27 GMT 2023
PRIMARY
PUBCHEM
23695348
Created by admin on Sat Dec 16 19:59:27 GMT 2023 , Edited by admin on Sat Dec 16 19:59:27 GMT 2023
PRIMARY
EPA CompTox
DTXSID9071054
Created by admin on Sat Dec 16 19:59:27 GMT 2023 , Edited by admin on Sat Dec 16 19:59:27 GMT 2023
PRIMARY
FDA UNII
VX2PU5FWF8
Created by admin on Sat Dec 16 19:59:27 GMT 2023 , Edited by admin on Sat Dec 16 19:59:27 GMT 2023
PRIMARY