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  • 4-氯丁醇醋酸酯

    4-Chlorobutyl Acetate

化合物简介

4-Chlorobutyl Acetate is a reagent used in the synthesis of novel cyclic ADP ribose derivatives. Also used in the synthesis of a transient receptor potential melastatin 2 antagonist involved in insulin secretion.

基本信息

CAS:6962-92-1
中文别名:4-氯丁基醋酸酯;乙酸4-氯丁酯;1-乙酰氧基-4-氯丁烷;4-氯丁基乙酸酯;4-氯丁基乙酸乙酯;
英文别名:4-Chlorobutyl acetate;
分子式:C6H11ClO2
分子量:150.603
精确质量:150.045
Psa:26.3
Logp:1.5685

编号系统

EINECS号:230-158-8
MDL号:MFCD00001013

物化性质

外观与性状:无色液体
密度:1.072g/mLat 25°C(lit.)
沸点:92°C22mm Hg(lit.)
闪点:148°F
折射率:n20/D 1.434(lit.)
水溶解性:inmisceable
稳定性:Stable at room temperature in closed containers under normal storage and handling conditions.
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

RTECS号:EL1328000
安全说明:S26-S36-S37/39
危险类别码:R22; R36/37/38
WGK Germany:3
危险品运输编码:3272
包装等级:III
危险品标志:Xn

生产方法及用途

合成路线

上游原料

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图谱

13C NMR : Predict


1H NMR : Predict


13C NMR : in CDCl3


1H NMR : 400 MHz in CDCl3


Mass spectrum (electron ionization)


Mass


IR : liquid film


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