| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 15th, 2006 | 16 | No |
Popular Name: 4-isobutyl-5-phenyl-4H-1,2,4-triazol-3-ylhydrosulfide 4-isobutyl-5-phenyl-4H-1,2,4-tri…
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CAS Numbers: 26029-10-7 , [26029-10-7]
| 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) | 2.68 | -1.29 | -9.94 | 1 | 3 | 0 | 33 | 233.34 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 1.870000000000000e+002 - 1.890000000000000e+002 | KeyOrganics |
| melting_point | 187 - 189 | KeyOrganics |
| MP | 187-189° | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
