Basic information
- Standard SMILES
Cc1nc(-c2ccc(OC(F)(F)F)cc2)cc(C(F)(F)F)c1CO- InChIKey
HTUGYHXSCCPNPW-UHFFFAOYSA-N- Molecular formula
- C15H11F6NO2
- Average molar mass
- 351.24 g/mol
- Monoisotopic mass
- 351.06939757
Names & identifiers
- Preferred name
- [2-Methyl-6-(4-trifluoromethoxy-phenyl)-4-trifluoromethyl-pyridin-3-yl]-methanol
- IUPAC
- [2-methyl-6-[4-(trifluoromethoxy)phenyl]-4-(trifluoromethyl)-3-pyridinyl]methanol
Names & synonyms
[2-Methyl-6-(4-trifluoromethoxy-phenyl)-4-trifluoromethyl-pyridin-3-yl]-methanolSCHEMBL1550032
Database identifiers
- PubChem CID
- 21935754
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 406
Related reactions
6 records
Compound notes
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