In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 18 | Yes |
Popular Name: 6-Fluoro-4-(trifluoromethyl)quinoline-2-carboxylic acid 6-Fluoro-4-(trifluoromethyl)quin…
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CAS Numbers: 596845-42-0 , [596845-42-0]
"6-Fluoro-4-(trifluoromethyl)quinoline-2-carboxylic acid, 97%"
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.27 | 6.36 | -43.6 | 0 | 3 | -1 | 53 | 258.15 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 168 - 171 | MolMall (formerly Molecular Diversity Preservation International) |
Purity | 95% | Fluorochem |