In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2005 | 17 | Yes |
Popular Name: 1-(3-bromophenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid 1-(3-bromophenyl)-3,5-dimethyl-1…
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CAS Numbers: 959582-69-5 , N/A
1-(3-Bromo-phenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid
1-(3-bromophenyl)-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) | 2.60 | 0.74 | -52.61 | 0 | 4 | -1 | 57 | 294.128 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 2.170000000000000e+002 - 2.190000000000000e+002 | KeyOrganics |
melting_point | 217 - 219 | KeyOrganics |
MP | 219-219° | Matrix Scientific |
Purity | 95% | Fluorochem |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |