2-Propenamide, 2-(hydroxymethyl)- | 832723-55-4
英文名称:
2-Propenamide, 2-(hydroxymethyl)-
CAS No.:
832723-55-4
分子式:
C4 H7 NO2
分子量:
101.10388
名称和标识符
InChIKey
LUOPFCDZQGKIDO-UHFFFAOYSA-N
Inchi
InChI=1S/C4H7NO2/c1-3(2-6)4(5)7/h6H,1-2H2,(H2,5,7)
SMILES
C=C(CO)C(=O)N
别名信息
- 英文别名 -
2-Propenamide, 2-(hydroxymethyl)-
2-(hydroxymethyl)prop-2-enamide
832723-55-4
2-(Hydroxymethyl)prop-2-enamide
AKOS006338266
SCHEMBL25805
DTXSID10590881
物化性质
计算特性
精确分子量
101.047678466g/mol
氢键供体数量
2
氢键受体数量
2
可旋转化学键数量
2
同位素质量
101.047678466g/mol
重原子数量
7
复杂度
97.9
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
0
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
疏水参数计算参考值(XlogP)
-1.1
拓扑分子极性表面积
63.3Ų
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