| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2009 | 17 | Yes |
Popular Name: 4-[3-(tert-butyl)-1,2,4-oxadiazol-5-yl]benzenecarbonitrile 4-[3-(tert-butyl)-1,2,4-oxadiazo…
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CAS Numbers: 1135282-95-9 , N/A
4-(3-(tert-Butyl)-1,2,4-oxadiazol-5-yl)benzonitrile
4-[3-(tert-Butyl)-1,2,4-oxadiazol-5-yl]-benzenecarbonitrile
| 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) | 3.18 | 5.85 | -7.33 | 0 | 4 | 0 | 63 | 227.267 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 1.450000000000000e+002 - 1.470000000000000e+002 | KeyOrganics |
| melting_point | 145 - 147 | KeyOrganics |
| MP | 145-147° | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
