In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 13 | Yes |
Popular Name: N-benzyl-2-cyanoacetamide N-benzyl-2-cyanoacetamide
Find On: PubMed — Wikipedia — Google
CAS Numbers: 10412-93-8 , [10412-93-8]
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) | 0.28 | 3.99 | -15.14 | 1 | 3 | 0 | 53 | 174.203 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 120 - 122 | KeyOrganics |
MP | 125 - 127 | Enamine Building Blocks |
MP | 125...127 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.