- InChI
- InChI=1S/C6H4F3N/c7-6(8,9)5-2-1-3-10-4-5/h1-4H
- InChI Key
- JTZSFNHHVULOGJ-UHFFFAOYSA-N
- Formula
- C6H4F3N
- SMILES
- FC(F)(F)c1cccnc1
- Molecular Weight1
- 147.10
- CAS
- 3796-23-4
- Other Names
-
- 3-Trifluoromethylpyridine
- 3-(CF3)-Pyridine
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| PAff | 892.50 | kJ/mol | NIST |
| BasG | 860.70 | kJ/mol | NIST |
| log10WS | -2.34 | Crippen Calculated Property | |
| logPoct/wat | 2.100 | Crippen Calculated Property | |
| McVol | 86.930 | ml/mol | McGowan Calculated Property |
Similar Compounds
Find more compounds similar to Pyridine, 3-(trifluoromethyl)-.
Sources
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