| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2008 | 16 | Yes |
Popular Name: 1-(4-butoxy-3-methoxyphenyl)ethan-1-one 1-(4-butoxy-3-methoxyphenyl)etha…
Find On: PubMed — Wikipedia — Google
CAS Number: 720-81-0
| 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) | 2.92 | 6.71 | -10.19 | 0 | 3 | 0 | 36 | 222.284 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 47 - 49 | Enamine Building Blocks |
| MP | 47...49 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | EP0125636A1; US4707481 | IBM Patent Data |
