| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2004 | 9 | No |
Popular Name: 6-oxohexanoic acid 6-oxohexanoic acid
Find On: PubMed — Wikipedia — Google
CAS Number: 928-81-4
6-Oxohexanoate; 6-Oxohexanoic acid; Adipate semialdehyde; C06102; Hexan-1-one-6-carboxylate
6-oxohexanoate; adipate semialdehyde
| 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) | 0.93 | 1.21 | -48.87 | 0 | 3 | -1 | 57 | 129.135 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| UniProt Database Links | CHDH_AZOSP | ChEBI |
| PUBCHEM_PATENT_ID | EP0154444A1; EP0600717A1; EP0790235A1; EP0844000A1; US4452796; US4503040; US4591459; US5227536; US5264613; US5349095; US5556864; US5843983 | IBM Patent Data |
| Patent Database Links | US2007196906 | ChEBI |
| Patent Database Links | WO2007120096 | ChEBI |
