Basic information
- Standard SMILES
CC(c1ccncc1)C(F)(F)F- InChIKey
KJCNCKIJIVGDQR-UHFFFAOYSA-N- Molecular formula
- C8H8F3N
- Average molar mass
- 175.15 g/mol
- Monoisotopic mass
- 175.06088375
Names & identifiers
- Preferred name
- 4-(2,2,2-Trifluoro-1-methyl-ethyl)pyridine
- IUPAC
- 4-(1,1,1-trifluoropropan-2-yl)pyridine
Names & synonyms
4-(2,2,2-trifluoro-1-methyl-ethyl)pyridineSCHEMBL2336440
Database identifiers
- PubChem CID
- 59570337
- Nikkaji
- J3.795.840I
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 138
Related reactions
4 records
Compound notes
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