| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 17 | Yes |
Popular Name: 5-amino-3-(cyanomethyl)-1-phenyl-1H-pyrazole-4-carbonitrile 5-amino-3-(cyanomethyl)-1-phenyl…
Find On: PubMed — Wikipedia — Google
CAS Number: 7152-40-1
5-Amino-3-cyanomethyl-1-phenyl-1H-pyrazole-4-carbonitrile
5-Amino-4-cyano-1-phenyl-1H-pyrazole-3-acetonitrile
5-Amino-4-cyano-1-phenyl-1H-pyrazole-3-acetonitrile, 98%
5-Amino-4-cyano-1-phenyl-3-pyrazoleacetonitrile
5-Amino-4-cyano-3-cyanomethyl-1-phenyl-1H-pyrazole
5-Amino-4-cyano-3-cyanomethyl-1-phenyl-1H-pyrazole,
| 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) | 1.15 | 6.1 | -12.23 | 2 | 5 | 0 | 91 | 223.239 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 161-166? | Alfa-Aesar |
| Melting_Point | 161-166° | Alfa-Aesar |
| MP | 163 - 165 | Enamine Building Blocks |
| MP | 163...165 | Enamine Building Blocks |
| MP | 165 - 167 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | EP0885890A1 | IBM Patent Data |
