| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2004 | 17 | Yes |
Popular Name: 4-Phenylbutyrophenone 4-Phenylbutyrophenone
Find On: PubMed — Wikipedia — Google
CAS Numbers: 13211-01-3 , 5407-91-0
| 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) | 4.05 | 10.34 | -8.74 | 0 | 1 | 0 | 17 | 224.303 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Boiling_Point | 180?/8mm | Alfa-Aesar |
| Boiling_Point | 180°/8mm | Alfa-Aesar |
| MP | 183 - 185 | Enamine Building Blocks |
| MP | 183...185 | Enamine Building Blocks |
| Melting_Point | 54-56? | Alfa-Aesar |
| Melting_Point | 54-56° | Alfa-Aesar |
| Mp [°C] | 55 - 59 | Acros Organics |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| S phrase | S24/25: Avoid contact with skin and eyes. | Acros Organics |
