Basic information
- Standard SMILES
COC(C)(C)c1cncc(Br)c1- InChIKey
JYDVMVALEWLPBH-UHFFFAOYSA-N- Molecular formula
- C9H12BrNO
- Average molar mass
- 230.1 g/mol
- Monoisotopic mass
- 229.01023
Names & identifiers
- Preferred name
- 3-Bromo-5-(2-methoxypropan-2-yl)pyridine
- IUPAC
- 3-bromo-5-(2-methoxypropan-2-yl)pyridine
Names & synonyms
3-bromo-5-(2-methoxypropan-2-yl)pyridine1255957-58-43-bromo-5-(methoxyisopropyl)pyridineSCHEMBL748434JYDVMVALEWLPBH-UHFFFAOYSA-NDB-3392173-bromo-5-(1-methoxy-1-methyl-ethyl)pyridine3-bromo-5-(1-methoxy-1-methyl-ethyl)-pyridine
Database identifiers
- PubChem CID
- 66788134
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 22.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 149
Related reactions
4 records
Compound notes
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