tert-butyl(1R,5S)-3-(2-chloropyrimidin-4-yl)-3,8-diazabicyclo[3.2.1]octane-8-carboxylate 基本信息
| 中文名称 | tert-butyl(1R,5S)-3-(2-chloropyrimidin-4-yl)-3,8-diazabicyclo[3.2.1]octane-8-carboxylate |
|---|---|
| 中文同义词 | 双环嘧啶;3-(2-氯嘧啶-4-基)-3,8-二氮杂双环[3.2.1]辛烷-8-羧酸叔丁酯;(1R,5S)-3-(2-氯嘧啶-4-基)-3,8-二氮杂双环[3.2.1]辛烷-8-甲酸叔丁酯 |
| 英文名称 | tert-butyl(1R,5S)-3-(2-chloropyrimidin-4-yl)-3,8-diazabicyclo[3.2.1]octane-8-carboxylate |
| 英文同义词 | tert-butyl(1R,5S)-3-(2-chloropyrimidin-4-yl)-3,8-diazabicyclo[3.2.1]octane-8-carboxylate;EOS-62176;tert-butyl 3-(2-chloropyrimidin-4-yl)-3,8-diazabicyclo[3.2.1]octane-8-carboxylate;3,8-Diazabicyclo[3.2.1]octane-8-carboxylic acid, 3-(2-chloro-4-pyrimidinyl)-, 1,1-dimethylethyl ester;3-(2-Chloro-pyrimidin-4-yl)-3,8-diaza-bicyclo[3.2.1]octane-8-carboxylic acid tert-butyl ester |
| CAS号 | 201162-46-1 |
| 分子式 | C15H21ClN4O2 |
| 分子量 | 324.81 |
| EINECS号 | |
| 相关类别 | |
| Mol文件 | 201162-46-1.mol |
| 结构式 | ![tert-butyl(1R,5S)-3-(2-chloropyrimidin-4-yl)-3,8-diazabicyclo[3.2.1]octane-8-carboxylate 结构式](CAS/20180703/GIF/201162-46-1.gif) |
tert-butyl(1R,5S)-3-(2-chloropyrimidin-4-yl)-3,8-diazabicyclo[3.2.1]octane-8-carboxylate 性质
| 沸点 | 480.3±35.0 °C(Predicted) |
|---|---|
| 密度 | 1.274±0.06 g/cm3(Predicted) |
| 储存条件 | 2-8°C, protect from light, stored under nitrogen |
| 酸度系数(pKa) | 4.51±0.31(Predicted) |
| 外观 | 无色至类白色固体 |
| InChI | InChI=1S/C15H21ClN4O2/c1-15(2,3)22-14(21)20-10-4-5-11(20)9-19(8-10)12-6-7-17-13(16)18-12/h6-7,10-11H,4-5,8-9H2,1-3H3 |
| InChIKey | OECIBZZKIXVOKZ-UHFFFAOYSA-N |
| SMILES | C12N(C(OC(C)(C)C)=O)C(CC1)CN(C1C=CN=C(Cl)N=1)C2 |