| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 11 | Yes |
Popular Name: 3-Hydroxy-1H-pyrazole-4-carboxylic acid ethyl ester 3-Hydroxy-1H-pyrazole-4-carboxyl…
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CAS Number: 7251-53-8
3-Hydroxy-1H-pyrazole-4-carboxylic acidethyl ester
3-hydroxy-1h-pyrazole-4-carboxylicacidethylester
ethyl 3-hydroxy-1H-pyrazole-4-carboxylate
Ethyl 3-hydroxypyrazole-4-carboxylate
Ethyl 5-Hydroxy-1H-pyrazole-4-carboxylate
ethyl 5-oxo-4,5-dihydro-1H-pyrazole-4-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) | 0.36 | -1.57 | -12 | 2 | 5 | 0 | 75 | 156.141 | 3 | ↓ |
| Ref Reference (pH 7) | -0.10 | 0.88 | -18.27 | 2 | 5 | 0 | 75 | 156.141 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.36 | -0.74 | -58.21 | 1 | 5 | -1 | 78 | 155.133 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Purity | 95%+ | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.