212-74-8 ((Tetraphenylene)

快速询单

结构式：

TetraphenyleneMOL文件

CAS号：

212-74-8

英文名称：

Tetraphenylene

分子式：

C₂₄H₁₆

分子量：

304.383846282959

Tetraphenylene(212-74-8)名称与标识符

名称

英文别名：

Tetraphenylene;Q1839256;KTQYWNARBMKMCX-UHFFFAOYSA-N;212-74-8;TETRAPHENYLENE, 95;DTXSID00993140;887R8CZW6Z;Tetrabenzocyclooctatetraene;UNII-887R8CZW6Z;AKOS040768539;7234-88-0;o-Tetraphenylene;

标识符

InChIKey：

KTQYWNARBMKMCX-UHFFFAOYSA-N

Inchi：

1S/C24H16/c1-2-10-18-17(9-1)19-11-3-4-13-21(19)23-15-7-8-16-24(23)22-14-6-5-12-20(18)22/h1-16H

SMILES：

C12C=CC=CC1=C1C=CC=CC1=C1C=CC=CC1=C1C=CC=CC=21

Tetraphenylene(212-74-8)物化性质

实验特性

PSA : 0
折射率 : 1.9130 (estimate)
沸点 : 380.21°C (rough estimate)
熔点 : 232-235 °C(lit.)
闪点 : 577.6°Cat760mmHg
密度 : 1.1440 (estimate)

计算特性

精确分子量 : 304.12528
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 : 304.125
重原子数量 : 24
复杂度 : 762
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 : 4
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : 4.7
拓扑分子极性表面积 : 0Å²

Tetraphenylene(212-74-8)相关文献

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4. Electron spin resonance spectroscopy of radical cations and anions of methylated biphenylenes, tetraphenylene, and octa-β-methyltetraphenylene
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6. Synthesis of biphenylenes and tetraphenylenes using copper-catalyzed coupling of arylzinc intermediates
S. M. Humayun Kabir,Masashi Hasegawa,Yoshiyuki Kuwatani,Masato Yoshida,Haruo Matsuyama,Masahiko Iyoda J. Chem. Soc. Perkin Trans. 1 2001 159
7. 28. Benzcyclooctatetraenes. Part V. The absorption spectra of tetraphenylene and 1 : 2 : 3 : 4 : 5 : 6-tribenz-Δ1 : 3 : 5 : 7-cyclooctatetraene in relation to their structures
W. S. Rapson,H. M. Schwartz,E. Theal Stewart J. Chem. Soc. 1944 73
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10. 89. Benzcyclooctatetraenes. Part III. Diphenylene and tetraphenylene
W. S. Rapson,R. G. Shuttleworth,J. N. van Niekerk J. Chem. Soc. 1943 326