| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2004 | 9 | Yes |
Popular Name: 6-Heptenoic acid 6-Heptenoic acid
Find On: PubMed — Wikipedia — Google
CAS Number: 1119-60-4
| 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) | 1.99 | 4.83 | -44.93 | 0 | 2 | -1 | 40 | 127.163 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Boiling_Point | 222-224? | Alfa-Aesar |
| Boiling_Point | 222-224° | Alfa-Aesar |
| Purity | 97% | Fluorochem |
| Melting_Point | ca -6? | Alfa-Aesar |
| Melting_Point | ca -6° | Alfa-Aesar |
| Patent Database Links | WO2005019170 | ChEBI |
