| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 9 | Yes |
Popular Name: 2-Pyridylacetonitrile 2-Pyridylacetonitrile
Find On: PubMed — Wikipedia — Google
CAS Numbers: 2739-97-1 , [2739-97-1]
| 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) | 0.73 | 3.86 | -10.57 | 0 | 2 | 0 | 37 | 118.139 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.73 | 4.11 | -37.86 | 1 | 2 | 1 | 38 | 119.147 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 23-25? | Alfa-Aesar |
| MP | 23-25° | Matrix Scientific |
| Boiling_Point | 66-68?/1mm | Alfa-Aesar |
| Boiling_Point | 66-68°/1mm | Alfa-Aesar |
| BP | 76-77°/2mm | Matrix Scientific |
| Purity | 98% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
| melting_point | Oil | KeyOrganics |
