Basic information
- CAS
6017-35-2- Standard SMILES
CCOc1ccc(N=NC(C#N)C#N)c(Br)c1- InChIKey
ZABALAFVWOCYIS-UHFFFAOYSA-N- Molecular formula
- C11H9BrN4O
- Average molar mass
- 293.12 g/mol
- Monoisotopic mass
- 291.99597
Names & identifiers
- Preferred name
- ((2-Bromo-4-ethoxyphenyl)azo)malononitrile
- IUPAC
- 2-[(2-bromo-4-ethoxyphenyl)diazenyl]propanedinitrile
Names & synonyms
((2-Bromo-4-ethoxyphenyl)azo)malononitrile6017-35-2F 22152-Brom-4-aethoxy-phenyl-azo-malonitril [German]MALONONITRILE, ((2-BROMO-4-ETHOXYPHENYL)AZO)-2-Brom-4-aethoxy-phenyl-azo-malonitril
Database identifiers
- CAS
6017-35-2- PubChem CID
- 22355
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 81.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 350
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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