1632-70-8 (5-甲基十一烷,5-Methylundecane)

快速询单

结构式：

5-甲基十一烷MOL文件

CAS号：

1632-70-8

中文名称：

5-甲基十一烷

英文名称：

5-Methylundecane

分子式：

C₁₂H₂₆

分子量：

170.334844112396

5-甲基十一烷(1632-70-8)名称与标识符

名称

英文别名：

Undecane, 5-methyl-;5-Methylundecane;Methylundecane;UNDECANE,5-METHYL-;LMFA11000466;NSC 158672;5-methyl-undecane;1632-70-8;DTXSID201015959;QULNVKABFWNUCW-UHFFFAOYSA-N;NSC-158672;NSC158672;5-methyl undecane;

标识符

InChIKey：

QULNVKABFWNUCW-UHFFFAOYSA-N

Inchi：

1S/C12H26/c1-4-6-8-9-11-12(3)10-7-5-2/h12H,4-11H2,1-3H3

SMILES：

C(C)(CCCC)CCCCCC

5-甲基十一烷(1632-70-8)物化性质

实验特性

PSA : 0
折射率 : 1.4202
沸点 : 206°C
熔点 : -50.8°C (estimate)
密度 : 0.7476

计算特性

精确分子量 : 170.20358
氢键供体数量 : 0
氢键受体数量 : 0
可旋转化学键数量 : 8
同位素质量 : 170.203450829g/mol
重原子数量 : 12
复杂度 : 76.1
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 : 1
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） : 6.4
拓扑分子极性表面积 : 0Å²

5-甲基十一烷(1632-70-8)相关文献

1. Reaction of organoboranes with neutral hydrogen peroxide
D. B. Bigley,D. W. Payling J. Chem. Soc. B 1970 1811
2. Reaction of organoboranes with neutral hydrogen peroxide
D. B. Bigley,D. W. Payling J. Chem. Soc. B 1970 1811
3. Ionic condensation of olefins by ionizing radiation. Effects of additives and the detailed mechanism
C. D. Wagner Trans. Faraday Soc. 1968 64 163
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Gary A. Strobel Nat. Prod. Rep. 2014 31 259
7. The reaction of organoboranes with neutral hydrogen peroxide
D. B. Bigley,D. W. Payling Chem. Commun. (London) 1968 938
8. The ‘trimer’ and ‘pentamer’ from the polymerisation of thiophen by polyphosphoric acid
R. F. Curtis,D. M. Jones,W. A. Thomas J. Chem. Soc. C 1971 234
9. Design of Pt/SAPO-11 bifunctional catalyst with superior metal–acid balance constructed via a novel one-step pre-loading strategy for enhancing n-dodecane hydroisomerization performance
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10. 1-Hexene: a renewable C6 platform for full-performance jet and diesel fuels
Benjamin G. Harvey,Heather A. Meylemans Green Chem. 2014 16 770