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化合物简介
基本信息
CAS:13547-70-1
中文别名:1-氯嚬哪酮;一氯频哪酮;1-氯频哪酮;1-氯-3,3-二甲基-2-丁酮;
英文别名:monochloropinacolone;MONOCHLOROPINAKOLONE;1-Chloro-3,3-dimethyl-2-butanone;CHLOROPINACOLONE;1-CHLOROPINACOLIN;chloromethyl tert-butyl ketone;Chloropinacoline;1-Chloropinacolin;tert-Butyl Chloromethyl Ketone;1-chloro-3,3-dimethyl-butan-2-one;chlorpinakolin;1-monochloropinacoline;1-chloro-3,3-dimethyl-2-butanone;2,2-dimethyl-4-chloro-butan-3-one;a-Chloropinacolin;
分子式:C6H11ClO
分子量:134.604
精确质量:134.05
Psa:17.07
Logp:1.8404
中文别名:1-氯嚬哪酮;一氯频哪酮;1-氯频哪酮;1-氯-3,3-二甲基-2-丁酮;
英文别名:monochloropinacolone;MONOCHLOROPINAKOLONE;1-Chloro-3,3-dimethyl-2-butanone;CHLOROPINACOLONE;1-CHLOROPINACOLIN;chloromethyl tert-butyl ketone;Chloropinacoline;1-Chloropinacolin;tert-Butyl Chloromethyl Ketone;1-chloro-3,3-dimethyl-butan-2-one;chlorpinakolin;1-monochloropinacoline;1-chloro-3,3-dimethyl-2-butanone;2,2-dimethyl-4-chloro-butan-3-one;a-Chloropinacolin;
分子式:C6H11ClO
分子量:134.604
精确质量:134.05
Psa:17.07
Logp:1.8404
编号系统
MDL号:MFCD00035688
RTECS号:EL7078000
PubChem号:24861553
EINECS号:236-920-6
RTECS号:EL7078000
PubChem号:24861553
EINECS号:236-920-6
物化性质
外观与性状:透明,淡黄色液体
密度:1.025g/mLat 25°C(lit.)
沸点:170-173°C(lit.)
熔点:−13°C(lit.)
闪点:153°F
折射率:n20/D 1.442(lit.)
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. Flammables-area.
蒸汽压:1.39mmHg at 25°C
密度:1.025g/mLat 25°C(lit.)
沸点:170-173°C(lit.)
熔点:−13°C(lit.)
闪点:153°F
折射率:n20/D 1.442(lit.)
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. Flammables-area.
蒸汽压:1.39mmHg at 25°C
安全信息
RTECS号:EL7078000
安全说明:S26-S36-S45-S38-S36/37/39-S28A
危险类别码:R22; R24; R26; R36/37/38
WGK Germany:3
海关编码:2914700090
危险品运输编码:UN 2810
危险类别:6.1
包装等级:III
危险品标志:T+
安全说明:S26-S36-S45-S38-S36/37/39-S28A
危险类别码:R22; R24; R26; R36/37/38
WGK Germany:3
海关编码:2914700090
危险品运输编码:UN 2810
危险类别:6.1
包装等级:III
危险品标志:T+
生产方法及用途
合成路线
上游原料
下游产品
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
