188916-67-8
| Name | (S)-(3-(3,4-dichlorophenyl)-3-(3-iodopropyl)piperidin-1-yl)(phenyl)methanone |
| CAS | 188916-67-8 |
| Molecular Formula | C21H22Cl2INO |
| Molecular Weight | 502.22 |
| MOL File | 188916-67-8.mol |
Chemical Properties
| Boiling point | 566.2±50.0 °C(Predicted) |
| density | 1.503 |
| pka | -2.05±0.40(Predicted) |
| InChI | InChI=1S/C21H22Cl2INO/c22-18-9-8-17(14-19(18)23)21(10-4-12-24)11-5-13-25(15-21)20(26)16-6-2-1-3-7-16/h1-3,6-9,14H,4-5,10-13,15H2/t21-/m0/s1 |
| InChIKey | XFAAEZSRGNMTTA-NRFANRHFSA-N |
| SMILES | C(N1CCC[C@@](C2=CC=C(Cl)C(Cl)=C2)(CCCI)C1)(C1=CC=CC=C1)=O |