In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2004 | 23 | Yes |
Popular Name: 1-methyl-3-(trifluoromethyl)-5-[3-(trifluoromethyl)phenoxy]-1H-pyrazole-4-carbonitrile 1-methyl-3-(trifluoromethyl)-5-[…
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CAS Number: 318469-13-5
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) | 3.95 | 6.66 | -7.51 | 0 | 4 | 0 | 50 | 335.207 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 99 - 101 | KeyOrganics |