Basic information
- Standard SMILES
CCOC(=O)c1ccc2cc(Br)c(F)cc2n1- InChIKey
IIOZPSKIXJJXCJ-UHFFFAOYSA-N- Molecular formula
- C12H9BrFNO2
- Average molar mass
- 298.11 g/mol
- Monoisotopic mass
- 296.98007
Names & identifiers
- Preferred name
- Ethyl 6-bromo-7-fluoroquinoline-2-carboxylate
- IUPAC
- ethyl 6-bromo-7-fluoroquinoline-2-carboxylate
Names & synonyms
1020574-89-3ETHYL 6-BROMO-7-FLUOROQUINOLINE-2-CARBOXYLATEethyl 6-bromo-7-fluoro-2-quinolinecarboxylateSCHEMBL1998568IIOZPSKIXJJXCJ-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 53404702
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 290
Related reactions
3 records
Compound notes
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