Basic information
- Standard SMILES
COc1ccnc(CBr)c1OC- InChIKey
XZMZSLFISAGQOJ-UHFFFAOYSA-N- Molecular formula
- C8H10BrNO2
- Average molar mass
- 232.07 g/mol
- Monoisotopic mass
- 230.98949
Names & identifiers
- Preferred name
- 2-Bromomethyl-3,4-dimethoxypyridine
- IUPAC
- 2-(bromomethyl)-3,4-dimethoxypyridine
Names & synonyms
2-(bromomethyl)-3,4-dimethoxypyridine107512-38-9SCHEMBL1137839XZMZSLFISAGQOJ-UHFFFAOYSA-N2-bromomethyl-3,4-dimethoxypyridineDB-163353
Database identifiers
- PubChem CID
- 20142802
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 31.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 134
Related reactions
4 records
Compound notes
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