1871-52-9 (三癸基环氧乙烷,1,3,5-Cyclooctatriene)

快速询单

结构式：

三癸基环氧乙烷MOL文件

CAS号：

1871-52-9

中文名称：

三癸基环氧乙烷

英文名称：

1,3,5-Cyclooctatriene

分子式：

C₈H₁₀

分子量：

106.165002346039

三癸基环氧乙烷(1871-52-9)名称与标识符

名称

中文别名：

1,3,5-环辛三烯;三癸基环氧乙烷;

英文别名：

1,3,5-Cyclooctatriene;cycloocta-1,3,5-triene;DTXSID001031072;(1Z,3Z,5Z)-cycloocta-1,3,5-triene;ICPMUWPXCAVOOQ-XCADPSHZSA-N;Q27117308;CHEBI:37891;AKOS006275550;1871-52-9;

标识符

InChIKey：

ICPMUWPXCAVOOQ-XCADPSHZSA-N

Inchi：

1S/C8H10/c1-2-4-6-8-7-5-3-1/h1-6H,7-8H2/b2-1-,5-3-,6-4-

SMILES：

C1C=CC=CC=CC1 |c:1,3,5|

三癸基环氧乙烷(1871-52-9)物化性质

实验特性

PSA : 0
折射率 : 1.5035
沸点 : 145.55°C
熔点 : -83.25°C
闪点 : 27.8°C
密度 : 0.8971

计算特性

精确分子量 : 106.0783
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 : 106.078
重原子数量 : 8
复杂度 : 111
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 : 3
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） : 3.3
拓扑分子极性表面积 : 0A^2

三癸基环氧乙烷(1871-52-9)相关文献

1. Syntheses and structures of novel zerovalent ruthenium monodentate amine complexes??
Toshiaki Suzuki,Masashi Shiotsuki,Kenji Wada,Teruyuki Kondo,Take-aki Mitsudo J. Chem. Soc. Dalton Trans. 1999 4231
2. A vacuum ultraviolet photoionization study on high-temperature decomposition of JP-10 (exo-tetrahydrodicyclopentadiene)
Long Zhao,Tao Yang,Ralf I. Kaiser,Tyler P. Troy,Bo Xu,Musahid Ahmed,Juan Alarcon,Daniel Belisario-Lara,Alexander M. Mebel,Yan Zhang,Chuangchuang Cao,Jiabiao Zou Phys. Chem. Chem. Phys. 2017 19 15780
3. Reactions of cyclooctatetraene. Part V. Selective reduction by metals and alkalis or acids
William O. Jones J. Chem. Soc. 1954 1808
4. Reactions of cyclooctatetraene. Part V. Selective reduction by metals and alkalis or acids
William O. Jones J. Chem. Soc. 1954 1808
5. Reactions of cyclo-octatetraene and its derivatives. Part III. Cycloocta-1,3,5-triene as a dienophile
I. A. Akhtar,G. I. Fray J. Chem. Soc. C 1971 2800
6. Ligand effect on the catalytic activity of ruthenium nanoparticles in ionic liquids
Gorka Salas,Paul S. Campbell,Catherine C. Santini,Karine Philippot,Margarida F. Costa Gomes,Agílio A. H. Pádua Dalton Trans. 2012 41 13919
7. Curly arrows, electron flow, and reaction mechanisms from the perspective of the bonding evolution theory
Juan Andrés,Patricio González-Navarrete,Vicent Sixte Safont,Bernard Silvi Phys. Chem. Chem. Phys. 2017 19 29031
8. Curly arrows, electron flow, and reaction mechanisms from the perspective of the bonding evolution theory
Juan Andrés,Patricio González-Navarrete,Vicent Sixte Safont,Bernard Silvi Phys. Chem. Chem. Phys. 2017 19 29031
9. Curly arrows, electron flow, and reaction mechanisms from the perspective of the bonding evolution theory
Juan Andrés,Patricio González-Navarrete,Vicent Sixte Safont,Bernard Silvi Phys. Chem. Chem. Phys. 2017 19 29031
10. Curly arrows, electron flow, and reaction mechanisms from the perspective of the bonding evolution theory
Juan Andrés,Patricio González-Navarrete,Vicent Sixte Safont,Bernard Silvi Phys. Chem. Chem. Phys. 2017 19 29031

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