(3R)-3-Chloro-3-fluoro-2-hydroxyquinolin-4(3H)-one
Basic information
- CAS
144603-83-8- Standard SMILES
O=C1Nc2ccccc2C(=O)[C@]1(F)Cl- InChIKey
MMJJDKQFBVGICO-SECBINFHSA-N- Molecular formula
- C9H5ClFNO2
- Average molar mass
- 213.59 g/mol
- Monoisotopic mass
- 212.9992843
Names & identifiers
- Preferred name
- (3R)-3-Chloro-3-fluoro-2-hydroxyquinolin-4(3H)-one
- IUPAC
- (3S)-3-chloro-3-fluoro-1H-quinoline-2,4-dione
Names & synonyms
3-Chloro-3-fluoro-2-hydroxyquinolin-4(3H)-oneDTXSID50932362144603-83-8(3R)-3-Chloro-3-fluoro-2-hydroxyquinolin-4(3H)-one
Database identifiers
- CAS
144603-83-8- PubChem CID
- 6922396
- DTXSID
DTXSID50932362
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 297
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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