308276-66-6
中文名称
叔-丁基 5-溴-2-(甲硫基)-6-羰基嘧啶-1-乙酸酯
英文名称
tert-Butyl (5-Bromo-2-(methylthio)-6-oxopyrimidin-1-yl)acetate
CAS
308276-66-6
分子式
C11H15BrN2O3S
分子量
335.22
MOL 文件
308276-66-6.mol
结构式
基本信息
中文别名
叔-丁基 5-溴-2-(甲硫基)-6-羰基嘧啶-1-乙酸酯
2-(5-溴-2-(甲硫基)-6-氧代嘧啶-1(6H)-基)乙酸叔丁酯
2-(5-溴-2-(甲硫基)-6-氧代嘧啶-1(6H)-基)乙酸叔丁酯
英文别名
tert-Butyl 5-bromo-2-(methylthio)-6-oxopyrimidine-1-acetate
tert-Butyl (5-Bromo-2-(methylthio)-6-oxopyrimidin-1-yl)acetate
Tert-butyl 2-(5-bromo-2-(methylthio)-6-oxopyrimidin-1(6H)-yl)acetate
1(6H)-Pyrimidineacetic acid, 5-bromo-2-(methylthio)-6-oxo-, 1,1-dimethylethyl ester
tert-Butyl (5-Bromo-2-(methylthio)-6-oxopyrimidin-1-yl)acetate
Tert-butyl 2-(5-bromo-2-(methylthio)-6-oxopyrimidin-1(6H)-yl)acetate
1(6H)-Pyrimidineacetic acid, 5-bromo-2-(methylthio)-6-oxo-, 1,1-dimethylethyl ester
物理化学性质
| 沸点 | 384.9±52.0 °C(Predicted) |
| 密度 | 1.47±0.1 g/cm3(Predicted) |
| 酸度系数(pKa) | -3.17±0.70(Predicted) |
| 形态 | solid |
| InChI | 1S/C11H15BrN2O3S/c1-11(2,3)17-8(15)6-14-9(16)7(12)5-13-10(14)18-4/h5H,6H2,1-4H3 |
| InChIKey | XYXNZAUIORCEKD-UHFFFAOYSA-N |
| SMILES | CSC1=NC=C(Br)C(=O)N1CC(=O)OC(C)(C)C |