185175

1-苄基-3-吡咯烷酮

98%

• 经验公式（希尔记法）: C₁₁H₁₃NO
• CAS号: 775-16-6
• 分子量: 175.23
• Beilstein: 1526217
• EC 号: 212-274-0
• MDL编号: MFCD00005342
• UNSPSC代码: 12352100
• PubChem化学物质编号: 24850673
• NACRES: NA.22

属性

• 方案: 98%
• 折射率: n20/D 1.539 (lit.)
• 沸点: 77 °C/0.01 mmHg (lit.)
• 密度: 1.091 g/mL at 25 °C (lit.)
• 官能团: ketone; phenyl
• 储存温度: 2-8°C
• SMILES字符串: O=C1CCN(C1)Cc2ccccc2
• InChI: 1S/C11H13NO/c13-11-6-7-12(9-11)8-10-4-2-1-3-5-10/h1-5H,6-9H2
• InChI key: DHGMDHQNUNRMIN-UHFFFAOYSA-N

说明

一般描述

The equilibrium constant for the ketoreductase-catalyzed reduction reaction of 1-benzyl-3-pyrrolidinone has been measured in n-hexane[1]. 1-Benzyl-3-pyrrolidinone on enzymatic asymmetric reduction yields enantiopure 1-benzyl-3-hydroxypyrrolidine, well known intermediate for various drugs[2].

应用

1-Benzyl-3-pyrrolidinone was used as starting reagent in the synthesis of vinyl triflate[3]. It was used to prepare chiral, alkenyl sulfoximines leading to highly functionalized diazabicycles[4].

安全信息

• 象形图: GHS07
• 警示用语：: Warning
• 危险声明: H315,H319,H335
• 预防措施声明: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• 危险分类: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• 靶器官: Respiratory system
• 储存分类代码: 10 - Combustible liquids
• WGK: WGK 3
• 闪点(°F): 230.0 °F - closed cup
• 闪点(°C): 110 °C - closed cup
• 个人防护装备: Eyeshields, Gloves, type ABEK (EN14387) respirator filter