Basic information
- Standard SMILES
CCOC(=O)CCCC(OC(=O)Oc1ccccc1)C(=O)c1ccc(F)c2ccccc12- InChIKey
YIXSRQBBOWXAJD-UHFFFAOYSA-N- Molecular formula
- C25H23FO6
- Average molar mass
- 438.4 g/mol
Names & identifiers
- Preferred name
- Ethyl 6-(4-fluoro-1-naphthyl)-6-oxo-5-phenoxycarbonyloxyhexanoate
- IUPAC
- ethyl 6-(4-fluoronaphthalen-1-yl)-6-oxo-5-phenoxycarbonyloxyhexanoate
Names & synonyms
SCHEMBL1360353YIXSRQBBOWXAJD-UHFFFAOYSA-Nethyl 6-(4-fluoro-1-naphthyl)-6-oxo-5-phenoxycarbonyloxyhexanoate
Database identifiers
- PubChem CID
- 18174734
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 12
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 632
Related reactions
3 records
Compound notes
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