| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 7 | Yes |
Popular Name: 1-Methyl-1H-pyrazol-5-ol 1-Methyl-1H-pyrazol-5-ol
Find On: PubMed — Wikipedia — Google
CAS Numbers: 10234-66-9 , 3310-35-8 , 33641-15-5 , [10234-66-9] , [33641-15-5] , [33641-16-6]
1-Methyl-1H-pyrazol-5-ol hydrochloride
1-methyl-4,5-dihydro-1H-pyrazol-5-one
| 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) | -0.17 | 0.85 | -15.33 | 1 | 3 | 0 | 38 | 98.105 | 0 | ↓ |
| Mid Mid (pH 6-8) | 0.29 | -0.4 | -41.81 | 0 | 3 | -1 | 41 | 97.097 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 110-112° | Matrix Scientific |
| MP | 110-114° | Oakwood Chemical |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| PUBCHEM_PATENT_ID | EP0835246A1; EP0847391A1; US5994353; US6100258; WO1997000863A1; WO1997000864A1 | IBM Patent Data |
| Warnings | IRRITANT | Matrix Scientific |
| Warnings | Irritant/Refrigerate | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.