| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 13 | No |
Popular Name: 2-hydroxy-1-(3-nitrophenyl)-1-ethanone 2-hydroxy-1-(3-nitrophenyl)-1-et…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 72802-41-6 , [72802-41-6]
| 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) | 0.76 | 3.54 | -18.87 | 1 | 5 | 0 | 83 | 181.147 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 88 - 90 | KeyOrganics |
| MP | 88-90° | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.