| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 16 | Yes |
Popular Name: 2-(5-benzoyl-2-thienyl)acetonitrile 2-(5-benzoyl-2-thienyl)acetonitrile
Find On: PubMed — Wikipedia — Google
CAS Number: 303144-54-9
| 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) | 3.50 | 7.98 | -12.88 | 0 | 2 | 0 | 41 | 227.288 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 122 - 124 | KeyOrganics |
| MP | 122-124° | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
