Basic information
- Standard SMILES
Cc1ccc(C#N)cc1Oc1ccc(C(F)(F)F)cn1- InChIKey
YPONSKSUZAJUMS-UHFFFAOYSA-N- Molecular formula
- C14H9F3N2O
- Average molar mass
- 278.23 g/mol
Names & identifiers
- Preferred name
- 4-Methyl-3-(5-trifluoromethylpyridine-2-yloxy)benzonitrile
- IUPAC
- 4-methyl-3-[[5-(trifluoromethyl)-2-pyridinyl]oxy]benzonitrile
Names & synonyms
4-methyl-3-(5-trifluoromethylpyridine-2-yloxy)benzonitrileSCHEMBL8299427
Database identifiers
- PubChem CID
- 21463645
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 45.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 376
Related reactions
4 records
Compound notes
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