CAS: 691863-84-0; 3-Pentylisoindolin-1-One

英文名称3-Pentylisoindolin-1-One
中文名称3-戊基异吲哚-1-酮
IUPAC名称3-pentylisoindolin-1-one
其它别名3-丁基苯酞杂质12; N-Butylphthalide-012
CAS编号691863-84-0
FDA UNII编号:QF5V8FYG6C
分子式:C13H17NO分子量:203.29
产品CID: 1687066
产品分类有机原料→分子砌块→芳杂环类化合物→吲哚啉类化合物

相似结构搜索
InChIKey: UDTBMOVPABGZEV-UHFFFAOYSA-N
InChI=1S/C13H17NO/c1-2-3-4-9-12-10-7-5-6-8-11(10)13(15)14-12/h5-8,12H,2-4,9H2,1H3,(H,14,15)
计算化学: 氢键受体数1.0氢键供体数1.0可旋转键数4.0

MSDS等安全信息

合成工艺路线路线简述

📜邻苯二甲酸亚胺置于三乙基硅烷,Trifluoroborane Diethyl Ether体系中,用二氯甲烷作为反应溶剂,化学反应 3.0H,反应生成丁苯酞杂质
参考文献:A Practical Two‐step Synthesis Of 3‐alkyl‐2,3‐dihydro‐1H‐isoindolin‐1‐ones
标题:A Practical Two‐step Synthesis Of 3‐alkyl‐2,3‐dihydro‐1H‐isoindolin‐1‐ones
摘要:A Flexible Approach To 3-Alkyl-2,3-Dihydro-1H-Isoindolin-1-Ones Via The Reductive-Alkylation Procedure Is Described. Present Method Is Versatile In Scope,Allowing The Easy Introduction Of Various C-3 Carbon-Substituents By Grignard Addition To Phthalimide.
DOI:10.1081/scc-120028358