| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2005 | 13 | Yes |
Popular Name: ethyl 2-methyl-2-(1H-1,2,4-triazol-1-yl)propanoate ethyl 2-methyl-2-(1H-1,2,4-triaz…
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CAS Number: 100159-13-5
| 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) | 0.51 | 6.55 | -9.75 | 0 | 5 | 0 | 57 | 183.211 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 0 | KeyOrganics |
| BP | 96°/2mm | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
