2899-02-7 (1,3-dichloro-1,3-bis(2,4,6-trichlorophenyl)urea,1,3-dichloro-1,3-bis(2,4,6-trichlorophenyl)urea)

快速询单

结构式：

1,3-dichloro-1,3-bis(2,4,6-trichlorophenyl)ureaMOL文件

CAS号：

2899-02-7

中文名称：

1,3-dichloro-1,3-bis(2,4,6-trichlorophenyl)urea

英文名称：

1,3-dichloro-1,3-bis(2,4,6-trichlorophenyl)urea

分子式：

C₁₃H₄Cl₈N₂O

分子量：

487.807655334473

1,3-dichloro-1,3-bis(2,4,6-trichlorophenyl)urea(2899-02-7)名称与标识符

名称

中文别名：

1,3-dichloro-1,3-bis(2,4,6-trichlorophenyl)urea;

英文别名：

1,3-dichloro-1,3-bis(2,4,6-trichlorophenyl)urea;N,N'-dichloro-bis(2,4,6-trichlorophenyl)urea;n,n'-dichlorobis(2,4,6-trichlorophenyl)urea;N,N'-dichloro-N,N'-bis-(2,4,6-trichloro-phenyl)-urea;AC1Q3VEX;CC 2;AR-1K1858;NSC56765;N,N'-dichloro bis(2,4,6-trichlorophenyl)urea;AC1L2QC7;N,N'-dichlorobis(2,4,6-trichlorodiphenyl)urea;N,N'-dichlorobis(2,4,6-trichlorophenyl) urea;N,N'-Dichlor-N,N'-bis-(2,4,6-trichlor-phenyl)-harnstoff;N,N'-dichloro-bis(2,4,6-trichlorophenyl)urea; n,n'-dichlorobis(2,4,6-trichlorophenyl)urea; N,N'-dichloro-N,N'-bis-(2,4,6-trichloro-phenyl)-urea; AC1Q3VEX; CC 2; AR-1K1858; NSC56765; N,N'-dichloro bis(2,4,6-trichlorophenyl)urea; AC1L2QC7; N,N'-dichlorobis(2,4,6-trichlorodiphenyl)urea; N,N'-dichlorobis(2,4,6-trichlorophenyl) urea; N,N'-Dichlor-N,N'-bis-(2,4,6-trichlor-phenyl)-harnstoff; N,N'-dichlorobis(2,4,6-trichlorophenyl)urea;;NSC-56765;N,N'-dichloro-bis(2,4,6-trichlorophenyl) urea;Urea,N'-dichloro-N,N'-bis(2,4,6-trichlorophenyl)-;Carbanilide, N,N',2,2',4,4',6,6'-octachloro-;Carbanilide,N',2,2',4,4',6,6'-octachloro-;NSC 56765;PQPYGYHIBMHXPC-UHFFFAOYSA-N;2899-02-7;N,N'-Dichloro-N,N'-bis(2,4,6-trichlorophenyl)urea;DTXSID4062690;Urea, N,N'-dichloro-N,N'-bis(2,4,6-trichlorophenyl)-;SCHEMBL20503204;

标识符

InChIKey：

PQPYGYHIBMHXPC-UHFFFAOYSA-N

Inchi：

1S/C13H4Cl8N2O/c14-5-1-7(16)11(8(17)2-5)22(20)13(24)23(21)12-9(18)3-6(15)4-10(12)19/h1-4H

SMILES：

ClN(C(N(C1C(=CC(=CC=1Cl)Cl)Cl)Cl)=O)C1C(=CC(=CC=1Cl)Cl)Cl

1,3-dichloro-1,3-bis(2,4,6-trichlorophenyl)urea(2899-02-7)物化性质

实验特性

PSA : 23.55
折射率 : 1.5940 (estimate)
沸点 : 535°Cat760mmHg
闪点 : 277.4°C
密度 : 1.7281 (rough estimate)

计算特性

精确分子量 : 483.78362
氢键供体数量 : 0
氢键受体数量 : 1
可旋转化学键数量 : 2
同位素质量 : 483.783
重原子数量 : 24
复杂度 : 396
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） : 7.9
拓扑分子极性表面积 : 23.6Å²

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