In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 13 | Yes |
Popular Name: N-(4-chlorophenyl)-2-cyanoacetamide N-(4-chlorophenyl)-2-cyanoacetamide
Find On: PubMed — Wikipedia — Google
CAS Numbers: 17722-17-7 , [17722-17-7]
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) | 1.25 | 4.39 | -17.79 | 1 | 3 | 0 | 53 | 194.621 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 203 - 205 | KeyOrganics |
MP | 203-205° | Matrix Scientific |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.