| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 18 | Yes |
Popular Name: 5-(4-n-Butylphenyl)-5-oxovaleric acid 5-(4-n-Butylphenyl)-5-oxovaleric…
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CAS Number: 97678-95-0
| 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) | 3.62 | 2.02 | -53.11 | 0 | 3 | -1 | 57 | 247.314 | 8 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 100-103° | Oakwood Chemical |
| Purity | 95% | Fluorochem |
