| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 25th, 2009 | 11 | Yes |
Popular Name: 1-(3-BROMO-4-HYDROXYPHENYL)ETHANONE 1-(3-BROMO-4-HYDROXYPHENYL)ETHANONE
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1836-06-2 , [1836-06-2]
| 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) | 2.35 | 3.48 | -39.1 | 0 | 2 | -1 | 40 | 214.038 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.35 | 2.85 | -8.07 | 1 | 2 | 0 | 37 | 215.046 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| PUBCHEM_PATENT_ID | EP0267670A1; EP0267670B1; EP0402644A1; EP0402644B1; EP0542136A1; EP0730452A1; EP0957102A1; EP0959075A1; EP0959076A1; EP0963984A1; EP1052255A1; US4868256; US4868257; US4886622; US5364866; US5550130; US5552414; US5554614; US5556858; US5559116; US5559117; US | IBM Patent Data |
