Basic information
- CAS
6017-48-7- Standard SMILES
Cc1cc(N=NC(C#N)C#N)ccc1[N+](=O)[O-]- InChIKey
DRRWXYSBAAPLFX-UHFFFAOYSA-N- Molecular formula
- C10H7N5O2
- Average molar mass
- 229.19 g/mol
- Monoisotopic mass
- 229.05997448
Names & identifiers
- Preferred name
- ((4-Nitro-m-tolyl)azo)malononitrile
- IUPAC
- 2-[(3-methyl-4-nitrophenyl)diazenyl]propanedinitrile
Names & synonyms
((4-Nitro-m-tolyl)azo)malononitrile6017-48-7F 2229MALONONITRILE, ((4-NITRO-m-TOLYL)AZO)-3-Methyl-4-nitro-phenyl-azo-malonitril [German]3-Methyl-4-nitro-phenyl-azo-malonitril
Database identifiers
- CAS
6017-48-7- PubChem CID
- 22362
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 393
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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