CAS: 17874-32-7; 6-(Tert-Butyl)-4-Methyl-2H-Chromen-2-One

该化合物是一种合成的丙氨酸衍生物,其特点是其异丁基和甲基替代成分,增强了其稳定性和疏水性能,该化合物主要用于香味应用,原因是其木质,类似琥珀的香味,在香水配方中具有长期和持续的性能,其结构改变有助于提高对氧化和紫外线降解的抗药性,使之适合用于个人护理和化妆品.此外,该化合物是有机合成的中间体,用于开发更复杂的丙氨基化合物,通常作为纯度高的细晶状粉供应,确保工业应用中的可复制性.

英文名称6-(Tert-Butyl)-4-Methyl-2H-Chromen-2-One
中文名称6-(叔丁基)-4-甲基-2H-苯并吡喃-2-酮
IUPAC名称6-(tert-butyl)-4-methyl-2H-chromen-2-one
其它别名6-T-Butyl-4-Methylcoumarin; 6-Tert-Butyl-4-Methyl-2H-Chromen-2-One; 6-Tert-Butyl-4-Methylcoumarin ,; 6-Tert-Butyl-4-Methylchromen-2-One; 6-Tert-Butyl-4-Methylcoumarin; 2H-1-Benzopyran-2-One, 6-(1,1-Dimethylethyl)-4-Methyl-
CAS编号17874-32-7
MFCD编号:MFCD00016968
分子式:C14H16O2分子量:216.28
产品CID: 919138
产品分类有机原料→分子砌块→芳杂环类化合物→香豆素类化合物

相似结构搜索
InChIKey: BVQZHRREUVIRFZ-UHFFFAOYSA-N
InChI=1S/C14H16O2/c1-9-7-13(15)16-12-6-5-10(8-11(9)12)14(2,3)4/h5-8H,1-4H3
计算化学: 氢键受体数2.0氢键供体数*可旋转键数*

MSDS等安全信息

GHS符号GHS07
警示词Warning
危险描述H302-H315-H319-H335
防范说明P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
安全声明24/25-36/37
危险类别码20/21/22

上下游产品

2-hydroxy-5-t-butyl-acetophenone acetic anhydride 2-Butynoic acid para-tert-butylphenol

合成工艺路线路线简述

📜4-Tert-Butylphenyl 3-Oxobutanoate置于硫酸体系中,化学反应 24.0H,以48%的收率获得4-甲基-6-叔丁基香豆素
参考文献:Preparation Of Newtert-Butyl Substituted Coumarins,Thiocoumarins And Dithiocoumarins
标题:Preparation Of Newtert-Butyl Substituted Coumarins,Thiocoumarins And Dithiocoumarins
摘要:6-Tert-Butyl-4-Methyl-And 6,8-Di-Tert-Butyl-4-Methylcoumarin Were Prepared From Tert-Butylphenols And Diketene Via The Corresponding Aryl Acetoacetates. 6-Tertbutyl-4-Methyl-Thiocoumarin (6) Was Obtained From 6-Tert-Butylthiophenol. Thionation With Lawesson'S Or Davy'S Reagent Led To The Related Thion-And Dithiocoumarins. The Structures Were Proved By NMR Spectroscopy And An X-Ray Structure Analysis Of 6.
Doi:10.1080/10426500701340949