In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2005 | 21 | Yes |
Popular Name: 3-(Heptafluoro-n-propyl)-5-phenylpyrazole 3-(Heptafluoro-n-propyl)-5-pheny…
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CAS Number: 54864-78-7
1H-Pyrazole,3-(1,1,2,2,3,3,3-heptafluoropropyl)-5-phenyl-
3-(Heptafluoropropyl)-5-phenylpyrazole
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) | 4.41 | 7.15 | -4.22 | 1 | 2 | 0 | 29 | 312.188 | 4 | ↓ |
Ref Reference (pH 7) | 4.41 | 7.34 | -4.89 | 1 | 2 | 0 | 29 | 312.188 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 85° | Fluorochem |
Purity | 97% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.