| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 15 | Yes |
Popular Name: 2-(4-pentylcyclohexyl)acetic acid 2-(4-pentylcyclohexyl)acetic acid
Find On: PubMed — Wikipedia — Google
CAS Number: 74603-16-0
| 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) | 4.33 | 8.68 | -46.4 | 0 | 2 | -1 | 40 | 211.325 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.33 | 7.56 | -6.14 | 1 | 2 | 0 | 37 | 212.333 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 60 - 62 | KeyOrganics |
| PUBCHEM_PATENT_ID | EP0058512A1; EP0133489A2; EP0300009A1; EP0300009B1; US4439015; US4556745; US4637897; US5190688 | IBM Patent Data |
