| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2005 | 14 | No |
Popular Name: 2-(2-Nitrophenyl)malondialdehyde 2-(2-Nitrophenyl)malondialdehyde
Find On: PubMed — Wikipedia — Google
CAS Numbers: 386715-37-3 , 53868-44-3 , [53868-44-3]
| 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) | 0.92 | 5.13 | -42.97 | 0 | 5 | -1 | 86 | 192.15 | 3 | ↓ |
| Ref Reference (pH 7) | 0.92 | 5.09 | -40.34 | 0 | 5 | -1 | 86 | 192.15 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.46 | 4.17 | -16.93 | 0 | 5 | 0 | 80 | 193.158 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 119-122° | Matrix Scientific |
| Purity | 95%+ | Fluorochem |
| Warnings | Irritant | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.