In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 7th, 2010 | 13 | No |
Popular Name: 2,2,2-Trifluoro-1-(4-hydroxyphenyl)ethanone 2,2,2-Trifluoro-1-(4-hydroxyphen…
Find On: PubMed — Wikipedia — Google
CAS Number: 1823-63-8
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) | 1.91 | 2.41 | -4.97 | 1 | 2 | 0 | 37 | 190.12 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.91 | 3.25 | -33.91 | 0 | 2 | -1 | 40 | 189.112 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.