3-Amino-3-(methylamino)-2-nitro-2-propenenitrile
Basic information
- CAS
16350-44-0- Standard SMILES
CNC(N)=C(C#N)[N+](=O)[O-]- InChIKey
HWPPOJPYTHOZGT-UHFFFAOYSA-N- Molecular formula
- C4H6N4O2
- Average molar mass
- 142.12 g/mol
- Monoisotopic mass
- 142.04907545
Names & identifiers
- Preferred name
- 3-Amino-3-(methylamino)-2-nitro-2-propenenitrile
- IUPAC
- 3-amino-3-(methylamino)-2-nitroprop-2-enenitrile
Names & synonyms
DTXSID3012367743-Amino-3-(methylamino)-2-nitro-2-propenenitrile3-Amino-3-(methylamino)-2-nitroprop-2-enenitrile16350-44-0
Database identifiers
- CAS
16350-44-0- PubChem CID
- 85437343
- DTXSID
DTXSID301236774
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 217
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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