In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2005 | 18 | Yes |
Popular Name: 3-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)propanoic acid 3-(3,5-dimethyl-1-phenyl-1H-pyra…
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CAS Numbers: 381697-29-5 , 381697-36-5 , [381697-36-5]
3-(3,5-Dimethyl-1-phenyl-1 H -pyrazol-4-yl)-propio
3-(3,5-Dimethyl-1-phenyl-1 H -pyrazol-4-yl)-propionic acid
3-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-propanoic acid
3-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-propionic 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) | 1.98 | 8.72 | -47.97 | 0 | 4 | -1 | 58 | 243.286 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 242 - 244 | Enamine Building Blocks |
MP | 242...244 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Warnings | IRRITANT | Matrix Scientific |