| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 11 | Yes |
Popular Name: 4-Ethoxybenzonitrile 4-Ethoxybenzonitrile
Find On: PubMed — Wikipedia — Google
CAS Numbers: 25117-74-2 , [25117-74-2]
| 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) | 2.13 | 2.63 | -5.32 | 0 | 2 | 0 | 33 | 147.177 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Boiling_Point | 258? | Alfa-Aesar |
| Boiling_Point | 258° | Alfa-Aesar |
| Melting_Point | 60-63? | Alfa-Aesar |
| Melting_Point | 60-63° | Alfa-Aesar |
| M.P | 62-64 °C | Indofine |
| MP | 62-64° | Matrix Scientific |
| Purity | 99% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
| PUBCHEM_PATENT_ID | WO2000017157A1 | IBM Patent Data |
