196-28-1 ((Dibenzo[c,mno]chrysene)

快速询单

结构式：

Dibenzo[c,mno]chryseneMOL文件

CAS号：

196-28-1

英文名称：

Dibenzo[c,mno]chrysene

分子式：

C₂₄H₁₄

分子量：

302.367966175079

Dibenzo[c,mno]chrysene(196-28-1)名称与标识符

名称

英文别名：

Dibenzo[c,mno]chrysene;naphtho(1,2-a)pyrene;Dibenzo(c,mno)chrysene;dibenzo[m,pqr]tetraphene;Einecs 205-897-4;Naphtho[1,2-a]pyrene;NS00026390;DTXSID80173261;hexacyclo[14.6.2.02,11.03,8.013,23.020,24]tetracosa-1,3,5,7,9,11,13(23),14,16(24),17,19,21-dodecaene;196-28-1;

标识符

InChIKey：

ANKRFBWKEPAECS-UHFFFAOYSA-N

Inchi：

1S/C24H14/c1-2-7-20-15(4-1)8-10-18-14-19-11-9-16-5-3-6-17-12-13-21(23(18)20)24(19)22(16)17/h1-14H

SMILES：

C12C3C=CC4=CC=CC(C=CC=1C1C5C=CC=CC=5C=CC=1C=3)=C24

Dibenzo[c,mno]chrysene(196-28-1)物化性质

实验特性

PSA : 0
折射率 : 1.912
沸点 : 552.3°Cat760mmHg
闪点 : 282°C
密度 : 1.313

计算特性

精确分子量 : 302.10962
氢键供体数量 : 0
氢键受体数量 : 0
可旋转化学键数量 : 0
同位素质量 : 302.10955
重原子数量 : 24
复杂度 : 480
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） : 7.2
拓扑分子极性表面积 : 0

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