| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 11 | Yes |
Popular Name: 4-Methoxy-2-methylbenzonitrile 4-Methoxy-2-methylbenzonitrile
Find On: PubMed — Wikipedia — Google
CAS Numbers: 21883-13-6 , [21883-13-6]
| 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 | 2.79 | -5.43 | 0 | 2 | 0 | 33 | 147.177 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 104°/5mm | Matrix Scientific |
| Purity | 95% | Fluorochem |
| Purity | 97% | Matrix Scientific |
| Warnings | IRRITANT, KEEP COLD | Matrix Scientific |
| Warnings | Irritant/Store in Freezer | Matrix Scientific |
| melting_point | Oil | KeyOrganics |
