2-DESCHLORO ARIPIPRAZOLE 基本信息
| 中文名称 | 2-DESCHLORO ARIPIPRAZOLE |
|---|---|
| 中文同义词 | 2-DESCHLORO阿立哌唑;2去氯阿立哌唑;阿立哌唑EP杂质D盐酸盐;阿立哌唑杂质D(EP);阿立派唑杂质D(EP);阿立哌唑-2-去氯;阿立哌唑杂质D 203395-82-8;阿立哌唑杂质1785 |
| 英文名称 | 2-Deschloro Aripiprazole |
| 英文同义词 | 2-Deschloro Aripiprazole;2(1H)-Quinolinone, 7-[4-[4-(3-chlorophenyl)-1-piperazinyl]butoxy]-3,4-dihydro-;Aripiprazole 2-Deschloro Impurity;Aripiprazole Imp.D;Aripiprazole EP Impurity D Hydrochloride;Aripiprazole Impurity 4（Aripiprazole EP Impurity D）;7-[4-[4-(3-chlorophenyl)piperazin-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one;Aripiprazole 2-Deschloro Imp |
| CAS号 | 203395-82-8 |
| 分子式 | C23H28ClN3O2 |
| 分子量 | 413.94 |
| EINECS号 | |
| 相关类别 | 对照品;化工原料;杂质对照品;239-阿立哌唑;阿立哌唑杂质;Aromatics, Impurities, Neurochemicals, Pharmaceuticals, Intermediates & Fine Chemicals |
| Mol文件 | 203395-82-8.mol |
| 结构式 |  |
2-DESCHLORO ARIPIPRAZOLE 性质
| 熔点 | 100-102°C |
|---|---|
| 沸点 | 626.9±55.0 °C(Predicted) |
| 密度 | 1.206±0.06 g/cm3(Predicted) |
| 储存条件 | Refrigerator |
| 溶解度 | 可溶于氯仿（少许）、甲醇（少许） |
| 形态 | 固体 |
| 酸度系数(pKa) | 14.42±0.20(Predicted) |
| 颜色 | 白色至类白色 |
| InChI | InChI=1S/C23H28ClN3O2/c24-19-4-3-5-20(16-19)27-13-11-26(12-14-27)10-1-2-15-29-21-8-6-18-7-9-23(28)25-22(18)17-21/h3-6,8,16-17H,1-2,7,9-15H2,(H,25,28) |
| InChIKey | SHHUSQIOAKPGMO-UHFFFAOYSA-N |
| SMILES | N1C2=C(C=CC(OCCCCN3CCN(C4=CC=CC(Cl)=C4)CC3)=C2)CCC1=O |