| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 9 | Yes |
Popular Name: 5-amino-1-methyl-1H-pyrazole-4-carbonitrile 5-amino-1-methyl-1H-pyrazole-4-c…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1955506-04-3 , 5334-41-8 , [5334-41-8]
1H-pyrazole-4-carbonitrile, 5-amino-1-methyl-
3-imino-2-methyl-2,3-dihydro-1H-pyrazole-4-carbonitrile
5-Amino-1-methylpyrazole-4-carbonitrile
5-Amino-4-cyano-1-methyl-1,2-pyrazole
5-Amino-4-cyano-1-methyl-1H-pyrazole
5-Amino-4-cyano-1-methylpyrazole
| 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) | -0.32 | 1.57 | -8.33 | 2 | 4 | 0 | 68 | 122.131 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 221 - 223 | KeyOrganics |
| MP | 221-223° | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 97% | Fluorochem |
| MP | >200° | Oakwood Chemical |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.