In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2005 | 15 | No |
Popular Name: 2-methyl-4-(2,6,6-trimethyl-1-cyclohexenyl)-but-2-enal 2-methyl-4-(2,6,6-trimethyl-1-cy…
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) | 4.54 | 3.17 | -4.66 | 0 | 1 | 0 | 17 | 206.329 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0371264A2; EP0371264B1; EP0628544A1; EP0628544B1; EP0905115A1; EP0971021A1; EP0971024A1; EP0971025A1; EP0971026A1; EP0971027A1; EP1019444A1; EP1034202A1; US3953524; US3989758; US3998856; US4000131; US4044028; US4916250; US5061819; US5077417; US5155238 | IBM Patent Data |