| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 2004 | 15 | Yes |
Popular Name: 5-(4-Methylphenyl)-5-oxovaleric acid 5-(4-Methylphenyl)-5-oxovaleric …
Find On: PubMed — Wikipedia — Google
CAS Numbers: 833-85-2 , [833-85-2]
5-(4-methylphenyl)-5-oxopentanoic acid
5-(4-Methylphenyl)-5-oxovalericacid
| 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) | 2.20 | 1.62 | -53.59 | 0 | 3 | -1 | 57 | 205.233 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 141-144° | Oakwood Chemical |
| MP | 152 - 154 | Enamine Building Blocks |
| MP | 152...154 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
