| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 18 | No |
Popular Name: dimethyl 2-(4-nitrophenyl)malonate dimethyl 2-(4-nitrophenyl)malonate
Find On: PubMed — Wikipedia — Google
CAS Numbers: 4033-88-9 , [4033-88-9]
| 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) | 0.78 | 4.28 | -12.18 | 0 | 7 | 0 | 98 | 253.21 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 1.250000000000000e+002 - 1.270000000000000e+002 | KeyOrganics |
| melting_point | 125 - 127 | KeyOrganics |
| MP | 125-127° | Matrix Scientific |
| Purity | 97% | Fluorochem |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
