| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 9 | Yes |
Popular Name: 4-Ethylcyclohexanone 4-Ethylcyclohexanone
Find On: PubMed — Wikipedia — Google
CAS Numbers: 5441-51-0 , [5441-51-0]
| 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) | 1.86 | 5.16 | -4.44 | 0 | 1 | 0 | 17 | 126.199 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Boiling_Point | 192-194? | Alfa-Aesar |
| Boiling_Point | 192-194° | Alfa-Aesar |
| BP | 194 | TCI |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| PUBCHEM_PATENT_ID | EP0862558A1; EP0915853A1; EP0931072A1; EP0944623A2; EP0998472A1; US6054412; US6054413; WO1997015559A1; WO1998005649A1; WO1998012182A1; WO1998027090A2; WO1998038169A1; WO1999006394A1; WO1999055702A1 | IBM Patent Data |
| Warnings | IRRITANT | Matrix Scientific |
