206-52-0 (苊并[1,2-b]吡嗪,Acenaphtho[1,2-b]pyrazine)

快速询单

结构式：

苊并[1,2-b]吡嗪MOL文件

CAS号：

206-52-0

中文名称：

苊并[1,2-b]吡嗪

英文名称：

Acenaphtho[1,2-b]pyrazine

分子式：

C₁₄H₈N₂

分子量：

204.226722717285

苊并[1,2-b]吡嗪(206-52-0)名称与标识符

名称

英文别名：

Acenaphtho[1,2-b]pyrazine;Acenaphtho(1,2-b)pyrazine;AKOS004909988;DTXSID50942789;JVF3N37ZXP;SCHEMBL21843250;7,10-Diazaflouranthene;206-52-0;acenaphthopyrazine;

标识符

InChIKey：

UEZUVIWRSYLYSJ-UHFFFAOYSA-N

Inchi：

1S/C14H8N2/c1-3-9-4-2-6-11-12(9)10(5-1)13-14(11)16-8-7-15-13/h1-8H

SMILES：

N1C=CN=C2C=1C1C=CC=C3C=CC=C2C=13

苊并[1,2-b]吡嗪(206-52-0)物化性质

实验特性

PSA : 25.78
折射率 : 1.892
沸点 : 390.1°Cat760mmHg
闪点 : 176°C
密度 : 1.375

计算特性

精确分子量 : 204.06884
氢键供体数量 : 0
氢键受体数量 : 2
可旋转化学键数量 : 0
同位素质量 : 204.068748
重原子数量 : 16
复杂度 : 252
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） : 2.4
拓扑分子极性表面积 : 25.8

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