| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 7th, 2009 | 16 | No |
Popular Name: 1-(4-Trifluoromethylphenyl)butane-1,3-dione 1-(4-Trifluoromethylphenyl)butan…
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CAS Number: 258346-69-9
| 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) | 2.17 | 8.19 | -15.94 | 0 | 2 | 0 | 34 | 230.185 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.92 | 8.13 | -40.59 | 0 | 2 | -1 | 40 | 229.177 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
