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Details

Stereochemistry ACHIRAL
Molecular Formula C7H12N2O2.H2O
Molecular Weight 174.1977
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of HEPTOXIME MONOHYDRATE

SMILES

O.ON=C1CCCCCC1=NO

InChI

InChIKey=JDZPMVCHLLDGRA-SLGVWIAZSA-N
InChI=1S/C7H12N2O2.H2O/c10-8-6-4-2-1-3-5-7(6)9-11;/h10-11H,1-5H2;1H2/b8-6+,9-7+;

HIDE SMILES / InChI

Molecular Formula H2O
Molecular Weight 18.0153
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C7H12N2O2
Molecular Weight 156.1824
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 02:33:28 GMT 2023
Edited
by admin
on Sat Dec 16 02:33:28 GMT 2023
Record UNII
4YY5DJI07Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HEPTOXIME MONOHYDRATE
MI  
Common Name English
1,2-CYCLOHEPTANEDIONE 1,2-DIOXIME MONOHYDRATE
Systematic Name English
HEPTOXIME MONOHYDRATE [MI]
Common Name English
Code System Code Type Description
PUBCHEM
135565481
Created by admin on Sat Dec 16 02:33:28 GMT 2023 , Edited by admin on Sat Dec 16 02:33:28 GMT 2023
PRIMARY
FDA UNII
4YY5DJI07Q
Created by admin on Sat Dec 16 02:33:28 GMT 2023 , Edited by admin on Sat Dec 16 02:33:28 GMT 2023
PRIMARY
MERCK INDEX
m5970
Created by admin on Sat Dec 16 02:33:28 GMT 2023 , Edited by admin on Sat Dec 16 02:33:28 GMT 2023
PRIMARY Merck Index
Related Record Type Details
ANHYDROUS->SOLVATE