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化合物简介
4-isopropylaniline is a useful synthetic intermediate. It is a metabolite of phenylurea herbicide isoproturon. It was used in the hydroamination of phenylacetylene.
基本信息
CAS:99-88-7
中文别名:枯胺;4-异丙基苯胺;丙苯胺;4-异丙基苯胺,枯胺;
英文别名:4-Isopropylaniline;4-propan-2-ylaniline;Benzenamine, 4-(1-methylethyl)-;
分子式:C9H13N
分子量:135.206
精确质量:135.105
Psa:26.02
Logp:2.9734
中文别名:枯胺;4-异丙基苯胺;丙苯胺;4-异丙基苯胺,枯胺;
英文别名:4-Isopropylaniline;4-propan-2-ylaniline;Benzenamine, 4-(1-methylethyl)-;
分子式:C9H13N
分子量:135.206
精确质量:135.105
Psa:26.02
Logp:2.9734
编号系统
MDL号:MFCD00007900
物化性质
外观与性状:淡棕色透明液体
密度:0.989g/mLat 25°C(lit.)
沸点:226-227°C745mm Hg(lit.)
熔点:-63 °C
闪点:198°F
折射率:n20/D 1.543(lit.)
水溶解性:insoluble
稳定性:Stable at room temperature in closed containers under normal storage and handling conditions. Light sensitive.
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. Store protected from light.
密度:0.989g/mLat 25°C(lit.)
沸点:226-227°C745mm Hg(lit.)
熔点:-63 °C
闪点:198°F
折射率:n20/D 1.543(lit.)
水溶解性:insoluble
稳定性:Stable at room temperature in closed containers under normal storage and handling conditions. Light sensitive.
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. Store protected from light.
安全信息
安全说明:S26-S36-S36/37
危险类别码:R20/21/22
WGK Germany:2
海关编码:2921491000
危险品标志:Xn
危险类别码:R20/21/22
WGK Germany:2
海关编码:2921491000
危险品标志:Xn
生产方法及用途
生产方法
其制备方法是以4-硝基异丙基苯进行还原,可以用铁粉还原,最好用催化加氢还原,减少污染。 用作合成除草剂异丙隆的中间体。
用途
用作合成除草剂异丙隆的中间体。
其制备方法是以4-硝基异丙基苯进行还原,可以用铁粉还原,最好用催化加氢还原,减少污染。 用作合成除草剂异丙隆的中间体。
用途
用作合成除草剂异丙隆的中间体。
合成路线
上游原料
下游产品
图谱
Predict 1H proton NMR

13C NMR : Predict

1H NMR : Predict

13C NMR : in CDCl3

1H NMR : 400 MHz in CDCl3

Mass spectrum (electron ionization)

Mass

IR : liquid film

LIQUID (NEAT)

gas
