Methyl 4-chloro-7-fluoroquinoline-2-carboxylate
Basic information
- CAS
1554589-53-5- Standard SMILES
COC(=O)c1cc(Cl)c2ccc(F)cc2n1- InChIKey
NVRUUFCPQMGHJA-UHFFFAOYSA-N- Molecular formula
- C11H7ClFNO2
- Average molar mass
- 239.63 g/mol
- Monoisotopic mass
- 239.0149343
Names & identifiers
- Preferred name
- Methyl 4-chloro-7-fluoroquinoline-2-carboxylate
- IUPAC
- methyl 4-chloro-7-fluoroquinoline-2-carboxylate
Names & synonyms
1554589-53-5methyl 4-chloro-7-fluoroquinoline-2-carboxylate
Database identifiers
- CAS
1554589-53-5- PubChem CID
- 97032483
- EC Number
- 193-929-7
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 277
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Compound notes
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