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化合物简介

1-​Bromononane is a useful synthetic intermediate. It is used in the synthesis of cyclooxygenase-2 (COX-2), a new class of selective COX-2 inactivators. It is also used to prepare alkylimidazoles by N-alkylation of imidazoles as antibacterial agents.

基本信息

CAS:693-58-3
中文别名:1-溴正壬烷;溴代正壬烷;正壬基溴;溴壬烷;溴代壬烷;壬基溴;
英文别名:N-NONYL BROMIDE;BROMONONANE;nonane,1-bromo;1-bromo-nonan;1-Bromo-n-nonane;Nonane, 1-bromo-;1-bromo-nonane;NONYL BROMIDE;1-Nonylbromide;1-Nonylbromid;
分子式:C9H19Br
分子量:207.151
精确质量:206.067
Psa:0.0
Logp:4.1319

编号系统

MDL号:MFCD00000278

物化性质

外观与性状:无色液体
密度:1.084g/mLat 25°C(lit.)
沸点:201°C(lit.)
熔点:-29ºC
闪点:194°F
折射率:n20/D 1.454(lit.)
水溶解性:immiscible
稳定性:Stable. Incompatible with strong oxidizing agents, strong bases.
储存条件:Keep away from heat, sparks, and flame. Keep away from sources of ignition. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

安全信息

安全说明:S23-S24/25-S37/39-S26
WGK Germany:3
危险类别码:R20; R36/37/38
海关编码:29033036
危险品运输编码:2810
危险品标志:Xn

生产方法及用途

用途
用于有机合成。

合成路线

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图谱

Predict 1H proton NMR


13C NMR : Predict


1H NMR : Predict


13C NMR : in CDCl3


1H NMR : 90 MHz in CDCl3


Mass spectrum (electron ionization)


Mass


Raman : 4880 A,200 M,liquid


IR : liquid film


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