| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 18 | Yes |
Popular Name: Ethyl 3-(4-Bromophenyl)-1-methyl1H-pyrazole-5-carboxylate Ethyl 3-(4-Bromophenyl)-1-methyl…
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CAS Number: 618070-50-1
Ethyl 3-(4-Bromophenyl)-1-methyl
Ethyl 3-(4-Bromophenyl)-1-methyl 1H-pyrazole-5-carboxylate
| 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) | 3.32 | 1.87 | -6.51 | 0 | 4 | 0 | 44 | 309.163 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 91-93° | Oakwood Chemical |
| Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.