| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2005 | 15 | Yes |
Popular Name: 4-(2,4-Dimethyl-phenyl)-4-oxobutyric acid 4-(2,4-Dimethyl-phenyl)-4-oxobut…
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CAS Numbers: 15880-03-2 , [15880-03-2]
4-(2,4-Dimethyl-phenyl)-4-oxo-butyric acid
4-(2,4-dimethyl-phenyl)-4-oxo-butyricacid
| 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) | 2.07 | 1.76 | -47.36 | 0 | 3 | -1 | 57 | 205.233 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 110-113° | Fluorochem |
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
