1-(1-ethyl-1H-imidazol-2-yl)-2,2,2-trifluoroethan-1-ol
Basic information
- CAS
107344-64-9- Standard SMILES
CCn1ccnc1C(O)C(F)(F)F- InChIKey
UUGCRMLPMASSPX-UHFFFAOYSA-N- Molecular formula
- C7H9F3N2O
- Average molar mass
- 194.15 g/mol
- Monoisotopic mass
- 194.0666974
Names & identifiers
- Preferred name
- 1-(1-ethyl-1H-imidazol-2-yl)-2,2,2-trifluoroethan-1-ol
- IUPAC
- 1-(1-ethylimidazol-2-yl)-2,2,2-trifluoroethanol
- English name
- 1-Ethyl-α-(trifluoromethyl)-1H-imidazole-2-methanol
- Molecular formula
- C7H9F3N2O
- Molecular weight
- 194.15
Names & synonyms
1-(1-ethyl-1H-imidazol-2-yl)-2,2,2-trifluoroethan-1-ol107344-64-9DTXSID501226062AKOS013293362EN300-19361131-Ethyl-I+/--(trifluoromethyl)-1H-imidazole-2-methanol1-Ethyl-α-(trifluoromethyl)-1H-imidazole-2-methanol1H-Imidazole-2-methanol, 1-ethyl-α-(trifluoromethyl)-
Database identifiers
- CAS
107344-64-9- PubChem CID
- 13615329
- DTXSID
DTXSID501226062
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 174
Physicochemical properties
- Melting point
- 88 · 88-90 °C(Solvent: Chloroform)
- Boiling point
- 278.932 · 278.932±40.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.36 · 1.360±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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