| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2004 | 12 | Yes |
Popular Name: 2'-iso-Propylacetophenone 2'-iso-Propylacetophenone
Find On: PubMed — Wikipedia — Google
CAS Numbers: 2142-65-6 , 294212-71-8
1-(2-Isopropyl-phenyl)-ethanone
Ethanol, 1-[6-(1-methylethylidene)-2,4-cyclohexadien-1-ylidene]-, (1E)- (9CI)
| 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) | 2.83 | 6.78 | -5.78 | 0 | 1 | 0 | 17 | 162.232 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 97% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.