Basic information
- Standard SMILES
Cl.O.O=CCn1c(=O)ccc2ncc(F)cc21- InChIKey
WIQMIOOWWBLYNQ-UHFFFAOYSA-N- Molecular formula
- C10H10ClFN2O3
- Average molar mass
- 260.65 g/mol
- Monoisotopic mass
- 260.036398
Names & identifiers
- Preferred name
- (7-fluoro-2-oxo-1,5-naphthyridin-1(2H)-yl)acetaldehyde hydrochloride monohydrate
- IUPAC
- 2-(7-fluoro-2-oxo-1,5-naphthyridin-1-yl)acetaldehyde;hydrate;hydrochloride
Names & synonyms
SCHEMBL3520140WIQMIOOWWBLYNQ-UHFFFAOYSA-N(7-fluoro-2-oxo-1,5-naphthyridin-1(2H)-yl)acetaldehyde hydrochloride monohydrate
Database identifiers
- PubChem CID
- 86646181
Properties
Computed structural properties
- Topological polar surface area
- 51.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 306
Related reactions
3 records
Compound notes
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