| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 1st, 2008 | 19 | Yes |
Popular Name: 3-[5-(trifluoromethyl)-2-pyridinyl]benzenecarboxylic acid 3-[5-(trifluoromethyl)-2-pyridin…
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CAS Numbers: 946409-32-1 , [946409-32-1]
3-(5-(Trifluoromethyl)pyridin-2-yl)benzoic acid
3-[5-(Trifluoromethyl)-2-pyridinyl]-benzenecarboxylic acid
| 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) | 3.37 | 6.98 | -57.32 | 0 | 3 | -1 | 53 | 266.198 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.37 | 7.2 | -61.54 | 1 | 3 | 0 | 54 | 267.206 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
