In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2004 | 17 | Yes |
Popular Name: 2-(Trifluoromethyl)quinoline-3-carboxylic acid 2-(Trifluoromethyl)quinoline-3-c…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 587886-26-8 , [587886-26-8]
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) | 2.80 | 5.42 | -50.48 | 0 | 3 | -1 | 53 | 240.16 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 207 - 209 | MolMall (formerly Molecular Diversity Preservation International) |
Purity | 97% | Fluorochem |