| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2004 | 14 | Yes |
1-(Pyridin-2-ylmethyl)piperidin-4-one; {7,7-dimeth ylbicyclo[2.2.1]heptan-1-yl}methanesulfonic acid
PYRIDINYLMETHYLPIPERIDINONE;DIMETHYLBICYCLOHEPTANYLMETHANESULFONICACI
| 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) | -0.20 | 2.76 | -45.07 | 0 | 3 | -1 | 57 | 217.31 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 1.590000000000000e+002 - 1.600000000000000e+002 | KeyOrganics |
| melting_point | 159 - 160 | KeyOrganics |
| MP | 159-160° | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
