HCID53701564

4-Di(2-hydroxyethyl)amino-4'-nitrostilbene

2-[N-(2-hydroxyethyl)-4-[2-(4-nitrophenyl)ethenyl]anilino]ethanol

C18H20N2O4328.4 g/molCAS 117563-47-0

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IDENTITY

结构与身份

标准SMILES: O=[N+]([O-])c1ccc(C=Cc2ccc(N(CCO)CCO)cc2)cc1
InChIKey: BUGPQBVYSHUWQJ-UHFFFAOYSA-N
分子式: C18H20N2O4
平均分子量: 328.4 g/mol
单同位素质量: 328.14230712

COMPUTED

结构计算性质

已同步

XLogP: 2.8
极性表面积: 89.5 Å²
氢键供体: 2
氢键受体: 5
可旋转键: 7
重原子: 24
形式电荷: 0
复杂度: 388

ALIASES

名称与别名

共 8 条

117563-47-04-di(2-hydroxyethyl)amino-4'-nitrostilbeneSCHEMBL8422918DTXSID20706057BUGPQBVYSHUWQJ-UHFFFAOYSA-N4-[N,N-bis(2-hydroxyethyl)amino]-4'-nitrostilbene2,2'-({4-[2-(4-Nitrophenyl)ethen-1-yl]phenyl}azanediyl)di(ethan-1-ol)2,2'-({4-[2-(4-Nitrophenyl)ethenyl]phenyl}azanediyl)di(ethan-1-ol)

REACTIONS