Basic information
- CAS
6017-54-5- Standard SMILES
N#CC(C#N)N=Nc1cccc2ccccc12- InChIKey
MHSXCCOAOKZNLS-UHFFFAOYSA-N- Molecular formula
- C13H8N4
- Average molar mass
- 220.23 g/mol
- Monoisotopic mass
- 220.07489627
Names & identifiers
- Preferred name
- (1-Naphthylazo)malononitrile
- IUPAC
- 2-(naphthalen-1-yldiazenyl)propanedinitrile
Names & synonyms
(1-Naphthylazo)malononitrile6017-54-51-Naphthyl-azo-malonitril [German]F 22431-Naphthyl-azo-malonitrilMALONONITRILE, (1-NAPHTHYLAZO)-
Database identifiers
- CAS
6017-54-5- PubChem CID
- 22366
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 72.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 367
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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