Basic information
- CAS
4061-71-6- Standard SMILES
N#CC(C#N)C(N=Nc1ccccc1)c1ccc(Cl)cc1- InChIKey
RRVCDHGNTSXIJI-UHFFFAOYSA-N- Molecular formula
- C16H11ClN4
- Average molar mass
- 294.74 g/mol
- Monoisotopic mass
- 294.0672241
Names & identifiers
- Preferred name
- (p-Chlorobenzyl)(phenylazo)malononitrile
- IUPAC
- 2-[(4-chlorophenyl)-phenyldiazenylmethyl]propanedinitrile
Names & synonyms
(p-Chlorobenzyl)(phenylazo)malononitrile4061-71-6F 2302Phenyl-azo-(4'-chlor-benzyl)-malonitril [German]MALONONITRILE, (p-CHLOROBENZYL)(PHENYLAZO)-Phenyl-azo-(4'-chlor-benzyl)-malonitril
Database identifiers
- CAS
4061-71-6- PubChem CID
- 19981
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 72.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 427
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…