| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 15 | No |
Popular Name: Ethyl 4-nitrophenylacetate Ethyl 4-nitrophenylacetate
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CAS Numbers: 5445-26-1 , [5445-26-1]
4-Nitrophenylacetic acid ethyl ester
ethyl 2-(4-nitrophenyl)acetate
| 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) | 2.31 | 3.03 | -10.86 | 0 | 5 | 0 | 72 | 209.201 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 196 / 20 | TCI |
| Melting_Point | 62-66? | Alfa-Aesar |
| Melting_Point | 62-66° | Alfa-Aesar |
| MP | 64 | TCI |
| MP | 64-66° | Matrix Scientific |
| Purity | 98% | Matrix Scientific |
| Warnings | Irritant | Matrix Scientific |
