| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2008 | 15 | Yes |
Popular Name: 4-(Trifluoromethoxy)isophthalonitrile 4-(Trifluoromethoxy)isophthaloni…
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CAS Numbers: 1020063-01-7 , 175278-16-7 , [1020063-01-7]
2,4-Dicyano-trifluoromethoxybenzene
2-(Trifluoromethoxy)terephthalonitrile
| 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) | 2.35 | 5.11 | -8.3 | 0 | 3 | 0 | 57 | 212.13 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 97% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.