CAS: 56-29-1; Hexobarbital

英文名称Hexobarbital
中文名称环已巴比妥
IUPAC名称5-(cyclohexen-1-yl)-1,5-dimethyl-1,3-diazinane-2,4,6-trione
其它别名Barbituricacid, 5-(1-cyclohexen-1-yl)-1,5-dimethyl- (8CI); (RS)-Hexobarbital; (?à)-5-(1-Cyclohexen-1-yl)-1,5-dimethylbarbituricacid; (?à)-Hexobarbital; (?à)-Hexobarbitone; 1,5-Dimethyl-5-(1-cyclohexenyl)barbituric acid; 5-(1-Cyclohexen-1-yl)-1,5-dimethylbarbituric acid; 5-(1-Cyclohexenyl-1)-1-methyl-5-methylbarbituric acid; Barbidorm; Citodon; Citopan; Cyclonal; Cyclopan; Dorico; Enhexymal; Evipal; Evipan; Hexanastab Oral; Hexenal(barbiturate); Hexobarbital; Hexobarbitone; Methexenyl; Methylhexabarbital; Methylhexabital; N-Methyl-5-cyclohexenyl-5-methylbarbituric acid; Narcosan; N°Ctivane; Sombucaps; Sombulex; Somnalert
CAS编号56-29-1
EINECS号:200-264-9
分子式:C12H16N2O3分子量:236.271
产品CID: 1536136
产品分类分析化学 → 标准品 → 法医和兽医标准品

相似结构搜索
InChIKey: UYXAWHWODHRRMR-UHFFFAOYNA-N
InChI=1/C12H16N2O3/c1-12(8-6-4-3-5-7-8)9(15)13-11(17)14(2)10(12)16/h6H,3-5,7H2,1-2H3,(H,13,15,17)
计算化学: 氢键受体数3.0氢键供体数1.0可旋转键数1.0

MSDS等安全信息

GHS象形图
GHS符号GHS07;
注释: Exclamation mark
危险类别急性毒性类别4(经口)
急性毒性类别4(吸入)
急性毒性类别4(经皮)
警示词Warning(警告)
危险描述H302 |吞咽有害.
H332 |吸入有害.
H312 |皮肤接触有害.
防范说明P264, P270, P301+P317, P330, and P501
UN编号UN 3249
危险品标志Xn: Harmful;
安全声明36/37/39-45-36/37-16-7
危险类别码R22
WGK Germany3

欧盟法规

ECHA物质ECHA物质C&L通报REACH预注册

上下游产品

Ethyl N-methylcarbamate N-Methylurea Methylcyclohexenylcyanoacetic acid ethyl ester cyclohexanone1-trimethylsilyl-3,5-dimethyl-5-(1-cyclohaxyl)barbituric acid 5-Cyclohex-1-enyl-1,5-dimethyl-3-(2-methyl-acryloyl)-pyrimidine-2,4,6-trione 5-(1-Cyclohexenyl)-1,5-dimethyl-4-thiobarbitursaeure 5-(1-Cyclohexenyl)-1,5-dimethyl-2,4-dithiobarbitursaeure

合成工艺路线路线简述

📜氰基环己亚基乙酸乙酯置于potassium Tert-Butylate体系中,用四氢呋喃,N,N-二甲基甲酰胺,叔丁醇作为反应溶剂,化学反应 6.02H,反应生成环已巴比妥
参考文献:Compounds Useful As Modulators Of Trpm8
标题:Compounds Useful As Modulators Of Trpm8
摘要:本发明包括作为trpm8调节剂有用的化合物,例如式(Ia),(Ib)和(Ic)的化合物,以及其亚属和种类;含有这些化合物的个人产品;以及利用这些化合物和个人产品,特别是利用增加或诱导化学感觉,如凉爽或冷感觉.