CAS: 597569-42-1; (1S,3Ar,6As)-2-(Tert-Butoxycarbonyl)Octahydrocyclopenta[c]Pyrrole-1-Carboxylic Acid

英文名称(1S,3Ar,6As)-2-(Tert-Butoxycarbonyl)Octahydrocyclopenta[c]Pyrrole-1-Carboxylic Acid
中文名称(1S,3aR,6aS)-2-(叔-丁氧羰基)八氢环戊[c]吡咯-1-羧酸
IUPAC名称(1S,3aR,6aS)-2-(tert-butoxycarbonyl)octahydrocyclopenta[c]pyrrole-1-carboxylic acid
其它别名HEXAHYDRO-CYCLOPENTA[C]PYRROLE-1,2-DICARBOXYLIC ACID 2-TERT-BUTYL ESTER; (1S,3aR,6aS)-Hexahydr°Cyclopenta[c]pyrrole-1,2(1H)-dicarboxylic acid 2-(tert-butyl) ester
CAS编号597569-42-1
MFCD编号:MFCD10688343
EINECS号:192-495-6
分子式:C13H21NO4分子量:255.31
产品CID: 1574472
产品分类有机原料→分子砌块→脂肪杂环类化合物→吡咯烷类化合物

相似结构搜索
InChIKey: SFBZDQKMJLUZQF-GUBZILKMSA-N
InChI=1S/C13H21NO4/c1-13(2,3)18-12(17)14-7-8-5-4-6-9(8)10(14)11(15)16/h8-10H,4-7H2,1-3H3,(H,15,16)/t8-,9-,10-/m0/s1
计算化学: 氢键受体数3.0氢键供体数1可旋转键数1

相似化合物

926276-09-7 1610351-01-3 926276-11-1

MSDS等安全信息

GHS符号GHS07
危险类别特定目标器官毒性 - 单次接触类别3
皮肤腐蚀/刺激类别2
严重眼刺激类别2A
警示词Warning
危险描述H335 |可能引起呼吸道刺激.
H315 |造成皮肤刺激.
H319 |造成严重眼刺激.
防范说明P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

欧盟法规

C&L通报

上下游产品

(1SR,3aRS,6aSR)-2-(tert-butoxycarbonyl)°Ctahydr°Cyclopenta[c]pyrrole-1-carboxylic acid (1S,3aR,6aS)-hexahydro-cyclopenta[c]pyrrole-1,2-dicarboxylic acid 2-tert-butyl ester ethyl ester 13H21NO4C13H21NO4 (R)-tert-butyl 2-(tert-butoxycarbonylamino)-2-((S)-2-methylenecyclopentyl)acetate(1S,3αR,6αS)-°Ctahydr°Cyclopenta[c]pyrrole-1-carboxylate hydr°Chloride (1S,3aR,6aS)-ethyl °Ctahydr°Cyclopenta[c]pyrrole-1-carboxylate hydr°Chloride

合成工艺路线路线简述

合成目标产物 (1S,3Ar,6As)-Hexahydro-Cyclopenta[c]Pyrrole-1,2(1H)-Dicarboxylic Acid 2-(Tert-Butyl) Ester 主要起始原料 Cyclopenta[c]Pyrrole-1,2(1H)-Dicarboxylic Acid, Hexahydro-, 2-(1,1-Dimethylethyl) 1-Ethyl Ester, (1S,3Ar,6As)-
(文献来源)合成步骤主要原料 Cyclopenta[c]Pyrrole-1,2(1H)-Dicarboxylic Acid, Hexahydro-, 2-(1,1-Dimethylethyl) 1-Ethyl Ester, (1S,3Ar,6As)-

📜在溶剂黄146,Sodium Nitrite,盐酸体系中,用二甲基亚砜,水作为反应溶剂,化学反应 6.0H,以0.45 G的收率获得产物(1S,3Ar,6As)-六氢环戊并[c]吡咯-1,2(1H)-二甲酸 2-叔丁酯
参考文献:Process For The Preparation Of A Viral Protease Inhibitor And Intermediates Thereof
标题:Process For The Preparation Of A Viral Protease Inhibitor And Intermediates Thereof
摘要:制备病毒蛋白酶抑制剂及其制备中有用的中间体的过程.