Basic information
- CAS
917396-31-7- Standard SMILES
CCc1nc(C(F)(F)F)ccc1CCl- InChIKey
IIPYNPCHGKFLIH-UHFFFAOYSA-N- Molecular formula
- C9H9ClF3N
- Average molar mass
- 223.62 g/mol
- Monoisotopic mass
- 223.0375615
Names & identifiers
- Preferred name
- 3-(Chloromethyl)-2-ethyl-6-(trifluoromethyl)pyridine
- IUPAC
- 3-(chloromethyl)-2-ethyl-6-(trifluoromethyl)pyridine
Names & synonyms
3-(chloromethyl)-2-ethyl-6-(trifluoromethyl)pyridine917396-31-7SCHEMBL4205067SCHEMBL4488040DTXSID20733146DB-193426
Database identifiers
- CAS
917396-31-7- PubChem CID
- 59834809
- DTXSID
DTXSID20733146
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 183
Related reactions
5 records
Compound notes
Loading…