| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2008 | 15 | No |
Popular Name: 6-Methoxy-1-oxo-1,2,3,4-tetrahydronaphthalene-2-carbaldehyde 6-Methoxy-1-oxo-1,2,3,4-tetrahyd…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 68950-67-4 , [68950-67-4]
6-Methoxy-1-oxo-1,2,3,4-tetrahydro-[2]-naphthaldehyde
| 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) | 3.22 | 4.02 | -41.38 | 0 | 3 | -1 | 49 | 203.217 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.19 | 5.6 | -19.68 | 0 | 3 | 0 | 43 | 204.225 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.19 | 5.17 | -12.67 | 0 | 3 | 0 | 43 | 204.225 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.22 | 3.45 | -9.53 | 1 | 3 | 0 | 47 | 204.225 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
