| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2004 | 13 | Yes |
Popular Name: 3-(4-bromophenyl)isoxazol-5-amine 3-(4-bromophenyl)isoxazol-5-amine
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CAS Numbers: 119162-53-7 , 81465-82-9 , [119162-53-7]
3-(4-bromo-phenyl)-isoxazol-5-ylamine
3-(4-Bromo-phenyl)isoxazol-5-ylamine
3-(4-bromophenyl)-1,2-oxazol-5-amine
3-(4-bromophenyl)-5-isoxazolamine
3-(4-bromophenyl)-isoxazole-5-amine
| 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) | 2.51 | -1.62 | -6.5 | 2 | 3 | 0 | 52 | 239.072 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 160-163° | Matrix Scientific |
| melting_point | 164 - 166 | KeyOrganics |
| Purity | 95% | Fluorochem |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.