1-Amino-2-cyano-2-diazonioethen-1-olate
Basic information
- CAS
85059-18-3- Standard SMILES
N#CC(=[N+]=[N-])C(N)=O- InChIKey
JHICVYMFEWHUBG-UHFFFAOYSA-N- Molecular formula
- C3H2N4O
- Average molar mass
- 110.07 g/mol
- Monoisotopic mass
- 110.0228607
Names & identifiers
- Preferred name
- 1-Amino-2-cyano-2-diazonioethen-1-olate
- IUPAC
- 2-cyano-2-diazoacetamide
Names & synonyms
2-diazo-2-cyanoacetamide85059-18-31-Amino-2-cyano-2-diazonioethen-1-olateSCHEMBL669928DTXSID70833862
Database identifiers
- CAS
85059-18-3- PubChem CID
- 71414404
- DTXSID
DTXSID70833862
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 68.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 203
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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