2-Bromo-1-(2,6-dimethoxypyridin-3-yl)ethanone
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Basic information
- Standard SMILES
COc1ccc(C(=O)CBr)c(OC)n1- InChIKey
AGAKOFSGCZIZRO-UHFFFAOYSA-N- Molecular formula
- C9H10BrNO3
- Average molar mass
- 260.08 g/mol
Names & identifiers
- Preferred name
- 2-Bromo-1-(2,6-dimethoxypyridin-3-yl)ethanone
- IUPAC
- 2-bromo-1-(2,6-dimethoxy-3-pyridinyl)ethanone
Names & synonyms
2-bromo-1-(2,6-dimethoxypyridin-3-yl)ethanone876318-94-4SCHEMBL1742344AGAKOFSGCZIZRO-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 86096126
Properties
Computed structural propertiesFilling in
- XLogP
- 1.9
- Topological polar surface area
- 48.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 200
Related reactions
2 records
Compound notes
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