| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 9 | Yes |
Popular Name: 2-acetyl-5-chlorothiophene 2-acetyl-5-chlorothiophene
Find On: PubMed — Wikipedia — Google
CAS Numbers: 6310-09-4 , 6310-9-4 , 9/4/6310 12:00:00 AM , [6310-09-4]
1-(5-chloro-2-thienyl)ethanone
1-(5-chlorothiophen-2-yl)ethan-1-one
1-(5-chlorothiophen-2-yl)ethanone
| 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) | 2.54 | 0.52 | -4.14 | 0 | 1 | 0 | 17 | 160.625 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP [°C] | 117 - 118 | Acros Organics |
| Boiling_Point | 117-118?/17mm | Alfa-Aesar |
| Boiling_Point | 117-118°/17mm | Alfa-Aesar |
| BP | 118 / 17 | TCI |
| Mp [°C] | 43 - 47 | Acros Organics |
| Melting_Point | 44-48? | Alfa-Aesar |
| Melting_Point | 44-48° | Alfa-Aesar |
| MP | 46 | TCI |
| MP | 46 - 49 | Enamine Building Blocks |
| MP | 46-49° | Matrix Scientific |
| MP | 46...49 | Enamine Building Blocks |
| MP | 52° | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 99% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
| S phrase | S24/25: Avoid contact with skin and eyes. | Acros Organics |
