Basic information
- Standard SMILES
Brc1cccnc1CCc1ccccc1- InChIKey
PHBYNHYLFOEGDK-UHFFFAOYSA-N- Molecular formula
- C13H12BrN
- Average molar mass
- 262.14 g/mol
Names & identifiers
- Preferred name
- 3-Bromo-2-phenethyl-pyridine
- IUPAC
- 3-bromo-2-(2-phenylethyl)pyridine
Names & synonyms
3-bromo-2-phenethyl-pyridineSCHEMBL1871187PHBYNHYLFOEGDK-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 58294397
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 177
Related reactions
10 records
Compound notes
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