In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2005 | 13 | Yes |
Popular Name: 1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid 1-methyl-3-(trifluoromethyl)-1H-…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 128694-63-3 , [128694-63-3]
"2-Methyl-5-trifluoromethyl-2H-pyrazole-3-carboxylic acid, 97%"
1-Methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxylicacid
1-Methyl-3-(trifluoromethyl)-2H-pyrazole-
1-Methyl-3-(trifluoromethyl)-2H-pyrazole-5-carboxylic acid
1-Methyl-3-trifluoromethyl-1H-pyrazole-5-carboxylic acid
1-Methyl-3-trifluoromethylpyrazole-5-carboxylic acid
1H-Pyrazole-5-carboxylic acid, 1-methyl-3-(trifluoromethyl)-
2-Methyl-5-trifluoromethyl-2H-pyrazole-3-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) | 1.33 | 3.72 | -37.08 | 0 | 4 | -1 | 58 | 193.104 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 130 - 131 | MolMall (formerly Molecular Diversity Preservation International) |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95% | Fluorochem |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.