Basic information
- Standard SMILES
CCOC(=O)c1cc2cc(F)c([N+](=O)[O-])cc2nc1OCC- InChIKey
KPLDIVRPKPDGNM-UHFFFAOYSA-N- Molecular formula
- C14H13FN2O5
- Average molar mass
- 308.26 g/mol
- Monoisotopic mass
- 308.08084968
Names & identifiers
- Preferred name
- Ethyl 2-ethoxy-6-fluoro-7-nitroquinoline-3-carboxylate
- IUPAC
- ethyl 2-ethoxy-6-fluoro-7-nitroquinoline-3-carboxylate
Names & synonyms
SCHEMBL6594520KPLDIVRPKPDGNM-UHFFFAOYSA-Nethyl 2-ethoxy-6-fluoro-7-nitroquinoline-3-carboxylate
Database identifiers
- PubChem CID
- 18536723
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 94.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 417
Related reactions
2 records
Compound notes
Loading…