| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 22 | No |
Popular Name: methyl 3-(4-formyl-2-nitrophenoxy)benzenecarboxylate methyl 3-(4-formyl-2-nitrophenox…
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CAS Number: 439095-08-6
Methyl 3-(4-formyl-2-nitrophenoxy)-benzenecarboxylate
methyl3-(4-formyl-2-nitrophenoxy)-benzenecarboxylate
| 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) | 3.52 | 4.21 | -21.37 | 0 | 7 | 0 | 98 | 301.254 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 1.120000000000000e+002 - 1.130000000000000e+002 | KeyOrganics |
| melting_point | 112 - 113 | KeyOrganics |
| MP | 112-113° | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.