Basic information
- Standard SMILES
COC(=O)c1cc(F)c(F)c2ccc(C)nc12- InChIKey
FLKMOQAAIRZPTP-UHFFFAOYSA-N- Molecular formula
- C12H9F2NO2
- Average molar mass
- 237.2 g/mol
Names & identifiers
- Preferred name
- 5,6-Difluoro-2-methylquinoline-8-carboxylic acid methyl ester
- IUPAC
- methyl 5,6-difluoro-2-methylquinoline-8-carboxylate
Names & synonyms
SCHEMBL4502380FLKMOQAAIRZPTP-UHFFFAOYSA-N5,6-difluoro-2-methylquinoline-8-carboxylic acid methyl ester
Database identifiers
- PubChem CID
- 21041191
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 300
Related reactions
2 records
Compound notes
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