Basic information
- CAS
6017-39-6- Standard SMILES
N#CC(C#N)N=Nc1ccc(Br)c(Cl)c1- InChIKey
ZUOPZPJDBOKHQB-UHFFFAOYSA-N- Molecular formula
- C9H4BrClN4
- Average molar mass
- 283.51 g/mol
- Monoisotopic mass
- 281.93079
Names & identifiers
- Preferred name
- ((4-Bromo-3-chlorophenyl)azo)malononitrile
- IUPAC
- 2-[(4-bromo-3-chlorophenyl)diazenyl]propanedinitrile
Names & synonyms
((4-Bromo-3-chlorophenyl)azo)malononitrile6017-39-63-Chlor-4-brom-phenyl-azo-malonitril [German]MALONONITRILE, ((4-BROMO-3-CHLOROPHENYL)AZO)-3-Chlor-4-brom-phenyl-azo-malonitril
Database identifiers
- CAS
6017-39-6- PubChem CID
- 22358
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
- 15
- Formal charge
- 0
- Complexity
- 323
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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