Basic information
- Standard SMILES
N#CC1=NC=CN(Br)C1- InChIKey
BNCHUFZQNPJLLX-UHFFFAOYSA-N- Molecular formula
- C5H4BrN3
- Average molar mass
- 186.01 g/mol
Names & identifiers
- Preferred name
- 4-Bromo-cyanopyrazine
- IUPAC
- 1-bromo-2H-pyrazine-3-carbonitrile
Names & synonyms
4-bromo-cyanopyrazineSCHEMBL618140BNCHUFZQNPJLLX-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 86648385
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 39.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 209
Related reactions
2 records
Compound notes
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