| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 15 | Yes |
Popular Name: 5-amino-1-(4-methylphenyl)-1H-pyrazole-4-carbonitrile 5-amino-1-(4-methylphenyl)-1H-py…
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CAS Numbers: 103646-82-8 , [103646-82-8]
5-Amino-1-(p-tolyl)-1H-pyrazole-4-carbonitrile
5-Amino-1-p-tolyl-1H-pyrazole-4-carbonitrile
| 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) | 1.40 | 5.76 | -7.67 | 2 | 4 | 0 | 68 | 198.229 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 116 - 120 | KeyOrganics |
| MP | 116-120° | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
