9078-44-8 (2-叔丁氧羰基氨基丙酸,2-tert-Butoxycarbonylamino-propionic acid)

快速询单

结构式：

2-叔丁氧羰基氨基丙酸MOL文件

CAS号：

9078-44-8

中文名称：

2-叔丁氧羰基氨基丙酸

英文名称：

2-tert-Butoxycarbonylamino-propionic acid

分子式：

C₈H₁₅NO₄

分子量：

189.209002733231

2-叔丁氧羰基氨基丙酸(9078-44-8)名称与标识符

名称

中文别名：

2-叔丁氧羰基氨基丙酸;

英文别名：

2-tert-Butoxycarbonylamino-propionic acid;

标识符

InChIKey：

QVHJQCGUWFKTSE-UHFFFAOYSA-N

Inchi：

1S/C8H15NO4/c1-5(6(10)11)9-7(12)13-8(2,3)4/h5H,1-4H3,(H,9,12)(H,10,11)

SMILES：

C(O)(=O)C(NC(OC(C)(C)C)=O)C

2-叔丁氧羰基氨基丙酸(9078-44-8)物化性质

实验特性

LogP : 1.37510
PSA : 75.63000
沸点 : 320.9 °C at 760 mmHg
闪点 : 320.9 °C at 760 mmHg
颜色与性状 : 白色至灰白色粉末
密度 : 1.126

计算特性

精确分子量 : 189.1
氢键供体数量 : 2
氢键受体数量 : 4
可旋转化学键数量 : 4
同位素质量 : 189.1
重原子数量 : 13
复杂度 : 207
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 1
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
拓扑分子极性表面积 : 75.6A^2

2-叔丁氧羰基氨基丙酸(9078-44-8)安全信息

储存条件：储存于0°C

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