| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 12 | Yes |
Popular Name: 3-Acetylthianaphthene 3-Acetylthianaphthene
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1128-05-8 , 26168-40-1 , [1128-05-8]
1-(1-benzothiophen-3-yl)ethan-1-one
1-(Benzo[b]thiophen-3-yl)ethanone
1-Benzo[b]thiophen-3-yl-ethanone
1-benzo[b]thiophen-3-ylethan-1-one
| 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) | 2.73 | 0.88 | -9.64 | 0 | 1 | 0 | 17 | 176.24 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Boiling_Point | 165-170?/10mm | Alfa-Aesar |
| Boiling_Point | 165-170°/10mm | Alfa-Aesar |
| Melting_Point | 61-66? | Alfa-Aesar |
| Melting_Point | 61-66° | Alfa-Aesar |
| MP | 62 - 64 | Enamine Building Blocks |
| MP | 62...64 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
