4371-30-6 ((1,1''-biphenyl-2,2'',4,4''-tetramine)

快速询单

结构式：

1,1''-biphenyl-2,2'',4,4''-tetramineMOL文件

CAS号：

4371-30-6

英文名称：

1,1''-biphenyl-2,2'',4,4''-tetramine

分子式：

C₁₂H₁₄N₄

分子量：

214.266361713409

1,1''-biphenyl-2,2'',4,4''-tetramine(4371-30-6)名称与标识符

名称

英文别名：

1,1''-biphenyl-2,2'',4,4''-tetramine;2,2',4,4'-Tetraaminobiphenyl;2,2',4,4'-tetraaminodiphenyl;2.4.2'.4'-Tetraamino-biphenyl;2.4.2'.4'-Tetraamino-diphenyl;AC1L7TFS;Biphenyl-2,4,2',4'-tetrayltetraamin;biphenyl-2,4,2',4'-tetrayltetraamine;CTK1D8746;diaminobenzidine;NSC243774;SureCN21372;[1,1'-Biphenyl]-2,2',4,4'-tetraamine;NSC-243774;SCHEMBL21372;SR-01000388908-1;SR-01000388908;4-(2,4-diaminophenyl)benzene-1,3-diamine;DTXSID30311530;AKOS004905257;4371-30-6;NSC 243774;2,2'-Diaminobenzidin;

标识符

InChIKey：

VGYQNMXWTMMHTP-UHFFFAOYSA-N

Inchi：

1S/C12H14N4/c13-7-1-3-9(11(15)5-7)10-4-2-8(14)6-12(10)16/h1-6H,13-16H2

SMILES：

NC1C=C(C=CC=1C1C=CC(=CC=1N)N)N

1,1''-biphenyl-2,2'',4,4''-tetramine(4371-30-6)物化性质

实验特性

PSA : 104.08

计算特性

精确分子量 : 214.12202
氢键供体数量 : 4
氢键受体数量 : 4
可旋转化学键数量 : 1
同位素质量 : 214.121846464g/mol
重原子数量 : 16
复杂度 : 209
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 : 104Å²

1,1''-biphenyl-2,2'',4,4''-tetramine(4371-30-6)相关文献

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