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化合物简介
N-Carbethoxy-4-piperidone is used in the preparation of 3-hydrazinopyridazines as antihypertensive agents as well as γ-carboline derivatives as potential serotonergic agents. N-Carbethoxy-4-piperidone is also an impurity of Loratadine.
基本信息
CAS:29976-53-2
中文别名:4-氧代-1-哌啶羧酸乙酯;1-乙氧基羰基-4-哌啶酮;4-氧代-1-哌啶甲酸乙酯;1-乙氧羰基-4-哌啶酮;1-乙;N-乙氧甲酰基-4-哌啶酮;N-乙羧氧基-4-哌啶酮;
英文别名:N-carboethoxy-4-piperidinone;1-CARBETHOXY-4-PIPERIDONE;carbethoxy-4-piperidone;Ethyl 4-Oxo-1-piperidinecarboxylate;4-Oxo-1-piperidinecarboxylic Acid Ethyl Ester;4-oxo-piperidine-1-carboxylic acid ethyl ester;N-Carbethoxy-4-piperidon;1-ethoxycarbonyl-4-piperidinone;1-carboethoxy-4-piperidone;1-Carbethoxy-4-piperidone;AURORA KA-3057;Loratadine impurity H;ethyl 4-oxopiperidine-1-carboxylate;N-ETHOXYCARBONYL-4-PIPERIDONE;N-CARBOETHOXY-4-PIPERIDONE;1-Ethoxycarbonyl-4-piperidone;1-Carbethoxy-4-piperidone,1-Ethoxycarbonyl-4-piperidone,Ethyl 4-oxo-1-piperidinecarboxylate;1-Piperidinecarboxylic acid, 4-oxo-, ethyl ester;N-Carbithoxy-4-Piperidone;N-Carbethoxypiperidone;
分子式:C8H13NO3
分子量:171.194
精确质量:171.09
Psa:46.61
Logp:0.7457
中文别名:4-氧代-1-哌啶羧酸乙酯;1-乙氧基羰基-4-哌啶酮;4-氧代-1-哌啶甲酸乙酯;1-乙氧羰基-4-哌啶酮;1-乙;N-乙氧甲酰基-4-哌啶酮;N-乙羧氧基-4-哌啶酮;
英文别名:N-carboethoxy-4-piperidinone;1-CARBETHOXY-4-PIPERIDONE;carbethoxy-4-piperidone;Ethyl 4-Oxo-1-piperidinecarboxylate;4-Oxo-1-piperidinecarboxylic Acid Ethyl Ester;4-oxo-piperidine-1-carboxylic acid ethyl ester;N-Carbethoxy-4-piperidon;1-ethoxycarbonyl-4-piperidinone;1-carboethoxy-4-piperidone;1-Carbethoxy-4-piperidone;AURORA KA-3057;Loratadine impurity H;ethyl 4-oxopiperidine-1-carboxylate;N-ETHOXYCARBONYL-4-PIPERIDONE;N-CARBOETHOXY-4-PIPERIDONE;1-Ethoxycarbonyl-4-piperidone;1-Carbethoxy-4-piperidone,1-Ethoxycarbonyl-4-piperidone,Ethyl 4-oxo-1-piperidinecarboxylate;1-Piperidinecarboxylic acid, 4-oxo-, ethyl ester;N-Carbithoxy-4-Piperidone;N-Carbethoxypiperidone;
分子式:C8H13NO3
分子量:171.194
精确质量:171.09
Psa:46.61
Logp:0.7457
编号系统
MDL号:MFCD00006188
物化性质
外观与性状:无色液体
密度:1.135g/mLat 25°C(lit.)
沸点:95-98 °C (1 mmHg)
闪点:190°F
折射率:n20/D 1.475(lit.)
水溶解性:slightly soluble
稳定性:Stable under normal temperatures and pressures.
储存条件:Keep away from sources of ignition. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
蒸汽压:0.00574mmHg at 25°C
密度:1.135g/mLat 25°C(lit.)
沸点:95-98 °C (1 mmHg)
闪点:190°F
折射率:n20/D 1.475(lit.)
水溶解性:slightly soluble
稳定性:Stable under normal temperatures and pressures.
储存条件:Keep away from sources of ignition. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
蒸汽压:0.00574mmHg at 25°C
安全信息
安全说明:S23-S24/25-S37/39-S26
危险类别码:R22; R36/38
WGK Germany:3
海关编码:2933399090
危险品标志:Xn
危险类别码:R22; R36/38
WGK Germany:3
海关编码:2933399090
危险品标志:Xn
生产方法及用途
生产方法
1、五氟利多的中间体。 1、医药中间体
用途
1、医药中间体
1、五氟利多的中间体。 1、医药中间体
用途
1、医药中间体
合成路线
-
参考文献
SUVEN LIFE SCIENCES LIMITED; Nirogi, Ramakrishna; Mohammed, Abdul Rasheed; Yarlagadda, Suresh; Ravella, Srinivasa Rao; Shinde, Anil Karbhari; Kamphampati, Ramasastri; Roayapalley, Praveen Kumar; Jayarajan, Pradeep; Bhyrapuneni, Gopinadh; Patnala, Sriramachandra Murthy; Ravula, Jyothsna; Jasti, Venkateswarlu Patent: US2014/187581 A1, 2014 ; Location in patent: Paragraph 0195-0198 ;
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 : 90 MHz in CDCl3
Mass
IR : liquid film











