Basic information
- Standard SMILES
CCOC(=O)C(=O)CC(C)(C)c1cc(F)ccc1OC- InChIKey
KEWHFESHKDONPU-UHFFFAOYSA-N- Molecular formula
- C15H19FO4
- Average molar mass
- 282.31 g/mol
Names & identifiers
- Preferred name
- 4-(5-Fluoro-2-methoxyphenyl)-4-methyl-2-oxopentanoic acid ethyl ester
- IUPAC
- ethyl 4-(5-fluoro-2-methoxyphenyl)-4-methyl-2-oxopentanoate
Names & synonyms
SCHEMBL5242773KEWHFESHKDONPU-UHFFFAOYSA-N4-(5-fluoro-2-methoxyphenyl)-4-methyl-2-oxopentanoic acid ethyl ester
Database identifiers
- PubChem CID
- 58599409
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 354
Related reactions
3 records
Compound notes
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