| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2007 | 14 | No |
Popular Name: 3-(4-Bromophenyl)-5-(chloromethyl)-1,2,4-oxadiazole 3-(4-Bromophenyl)-5-(chloromethy…
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CAS Numbers: 110704-42-2 , [110704-42-2]
1,2,4-oxadiazole, 3-(4-bromophenyl)-5-(chloromethyl)-
3-(4-Bromo-phenyl)-5-chloromethyl-[1,2,4]oxadiazole
| 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) | 3.43 | -0.98 | -5.95 | 0 | 3 | 0 | 38 | 273.517 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 6.300000000000000e+001 - 6.500000000000000e+001 | KeyOrganics |
| melting_point | 63 - 65 | KeyOrganics |
| MP | 63-65° | Matrix Scientific |
| Purity | 95% | Fluorochem |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.