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化合物简介
2-Methylcyclopentanone is a useful synthetic intermediate. It was used in the synthesis of MK-0354, a partial agonist of nicotinic acid and G-protein-coupled receptor 109a. It can also be used to prepare Falcipain inhibitors.
基本信息
CAS:1120-72-5
中文别名:
英文别名:rac-2-methylcyclopentanone;2-Methylcyclopentan-1-one;2-methyl-cyclopentanone;a-Methylcyclopentanone;Cyclopentanone, 2-methyl-;methylcyclopentone;2-methyl-cyclopentanon;d,l-2-methylcyclopentanone;
分子式:C6H10O
分子量:98.143
精确质量:98.0732
Psa:17.07
Logp:1.3755
中文别名:
英文别名:rac-2-methylcyclopentanone;2-Methylcyclopentan-1-one;2-methyl-cyclopentanone;a-Methylcyclopentanone;Cyclopentanone, 2-methyl-;methylcyclopentone;2-methyl-cyclopentanon;d,l-2-methylcyclopentanone;
分子式:C6H10O
分子量:98.143
精确质量:98.0732
Psa:17.07
Logp:1.3755
编号系统
EINECS号:214-318-4
PubChem号:24857339
MDL号:MFCD00001414
BRN号:1305058
PubChem号:24857339
MDL号:MFCD00001414
BRN号:1305058
物化性质
外观与性状:透明无色液体
密度:0.917g/mLat 25°C(lit.)
沸点:139°C(lit.)
熔点:-75ºC
闪点:79°F
折射率:n20/D 1.435(lit.)
水溶解性:soluble
稳定性:Stable under normal temperatures and pressures.
储存条件:Flammables area
蒸汽压:5.8mmHg at 25°C
密度:0.917g/mLat 25°C(lit.)
沸点:139°C(lit.)
熔点:-75ºC
闪点:79°F
折射率:n20/D 1.435(lit.)
水溶解性:soluble
稳定性:Stable under normal temperatures and pressures.
储存条件:Flammables area
蒸汽压:5.8mmHg at 25°C
安全信息
安全说明:S16-S29-S33
WGK Germany:3
危险类别码:R10
海关编码:2914299000
危险品运输编码:UN 1224 3/PG 3
危险类别:3.2
包装等级:III
危险品标志:F
WGK Germany:3
危险类别码:R10
海关编码:2914299000
危险品运输编码:UN 1224 3/PG 3
危险类别:3.2
包装等级:III
危险品标志:F
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
