| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 23rd, 2008 | 13 | Yes |
Popular Name: 4-(2-Cyanoacetyl)benzonitrile 4-(2-Cyanoacetyl)benzonitrile
Find On: PubMed — Wikipedia — Google
CAS Number: 71292-11-0
| 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) | 0.67 | 5.83 | -18.47 | 0 | 3 | 0 | 65 | 170.171 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 128 - 129 | KeyOrganics |
