| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 12 | Yes |
Popular Name: 1-(2,4,5-Trimethylphenyl)ethanone 1-(2,4,5-Trimethylphenyl)ethanone
Find On: PubMed — Wikipedia — Google
CAS Number: 2040-07-5
1-(2,4,5-trimethylphenyl)ethan-1-one
2',4',5'-TRIMETHYLACETOPHENONE
| 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) | 3.04 | 2.52 | -5.86 | 0 | 1 | 0 | 17 | 162.232 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 10 - 11 | Enamine Building Blocks |
| M.P | 10-11 °C | Indofine |
| MP | 10...11 | Enamine Building Blocks |
| MP | 10° | Matrix Scientific |
| BP | 246° | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Warnings | IRRITANT | Matrix Scientific |
