Basic information
- Standard SMILES
COC(=O)CCCCc1nc(-c2ccccc2C(F)(F)F)co1- InChIKey
PQNBYZLOYZMZPF-UHFFFAOYSA-N- Molecular formula
- C16H16F3NO3
- Average molar mass
- 327.3 g/mol
- Monoisotopic mass
- 327.10822786
Names & identifiers
- Preferred name
- 5-[4-(2-Trifluoromethyl-phenyl)-oxazol-2-yl]-pentanoic acid methyl ester
- IUPAC
- methyl 5-[4-[2-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]pentanoate
Names & synonyms
5-[4-(2-trifluoromethyl-phenyl)-oxazol-2-yl]-pentanoic acid methyl esterSCHEMBL3047857
Database identifiers
- PubChem CID
- 59167779
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 389
Related reactions
7 records
Compound notes
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