In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2006 | 17 | Yes |
Popular Name: 1-(4-chlorophenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid 1-(4-chlorophenyl)-3,5-dimethyl-…
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CAS Number: 113808-87-0
1-(4-Chloro-phenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid
1-(4-chloro-phenyl)-3,5-dimethyl-1h-pyrazole-4-carboxylicacid
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) | 2.28 | 1.36 | -50.53 | 0 | 4 | -1 | 58 | 249.677 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 219 - 221 | Enamine Building Blocks |
MP | 219...221 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95% | Fluorochem |
Purity | 95+% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |