In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 13 | Yes |
Popular Name: 4-(1H-IMIDAZOL-1-YL)BENZONITRILE 4-(1H-IMIDAZOL-1-YL)BENZONITRILE
Find On: PubMed — Wikipedia — Google
CAS Numbers: 25372-03-6 , N/A , [25372-03-6]
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) | 1.02 | 7.26 | -9.5 | 0 | 3 | 0 | 42 | 169.187 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 151 - 153 | KeyOrganics |
MP | 151-153° | Matrix Scientific |
MP | 154 | TCI |
Purity | 97% | Fluorochem |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |