In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 12th, 2008 | 10 | Yes |
Popular Name: Methyl 4-iodo-1H-pyrazole-3-carboxylate Methyl 4-iodo-1H-pyrazole-3-carb…
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CAS Numbers: , 136944-79-1 , [136944-79-1]
1H-pyrazole-5-carboxylic acid, 4-iodo-, methyl ester
methyl 4-iodo-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) | 1.40 | 2.66 | -8.39 | 1 | 4 | 0 | 55 | 252.011 | 2 | ↓ |
Ref Reference (pH 7) | 1.40 | 2.63 | -4.86 | 1 | 4 | 0 | 55 | 252.011 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 95% | Fluorochem |