3-Bromo-4-methoxyquinoline
Basic information
- CAS
36255-25-1- Standard SMILES
COc1c(Br)cnc2ccccc12- InChIKey
RKXMXHCOBXEHAD-UHFFFAOYSA-N- Molecular formula
- C10H8BrNO
- Average molar mass
- 238.08 g/mol
- Monoisotopic mass
- 236.97893
Names & identifiers
- Preferred name
- 3-Bromo-4-methoxyquinoline
- IUPAC
- 3-bromo-4-methoxyquinoline
Names & synonyms
3-Bromo-4-methoxyquinoline36255-25-1DTXSID80315548RefChem:277474DTXCID70266671RKXMXHCOBXEHAD-UHFFFAOYSA-NNSC295389NSC-295389
Database identifiers
- CAS
36255-25-1- PubChem CID
- 325839
- DTXSID
DTXSID80315548
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 22.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 176
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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