Basic information
- Standard SMILES
CCCCOc1ncc(C)cc1-c1cc(C(F)(F)F)ccc1F- InChIKey
DMPYLVRXXHMLDS-UHFFFAOYSA-N- Molecular formula
- C17H17F4NO
- Average molar mass
- 327.32 g/mol
- Monoisotopic mass
- 327.12462681
Names & identifiers
- Preferred name
- 2-Butoxy-3-(2-fluoro-5-trifluoromethyl-phenyl)-5-methyl-pyridine
- IUPAC
- 2-butoxy-3-[2-fluoro-5-(trifluoromethyl)phenyl]-5-methylpyridine
Names & synonyms
2-Butoxy-3-(2-fluoro-5-trifluoromethyl-phenyl)-5-methyl-pyridineSCHEMBL2702890
Database identifiers
- PubChem CID
- 21109697
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 22.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 363
Related reactions
4 records
Compound notes
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