| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2009 | 13 | Yes |
Popular Name: 1-(tert-butyl)-5-methyl-1H-pyrazole-4-carboxylic acid 1-(tert-butyl)-5-methyl-1H-pyraz…
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CAS Numbers: 288251-51-4 , [288251-51-4]
1-(tert-butyl)-5-methyl-1h-pyrazole-4-carboxylicacid
1-tert-butyl-5-methyl-1H-pyrazole-4-carboxylic acid
| 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) | 1.29 | 4.03 | -52.22 | 0 | 4 | -1 | 58 | 181.215 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 132 - 133 | KeyOrganics |
| MP | 132 - 134 | Enamine Building Blocks |
| MP | 132-133° | Matrix Scientific |
| MP | 132...134 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
