t-butyl benzyl(propyl)carbamate | 857349-72-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: t-butyl benzyl(propyl)carbamate
• 英文别名: tert-butyl N-benzyl-N-propylcarbamate
• CAS: 857349-72-5
• 化学式: C₁₅H₂₃NO₂
• 分子量: 249.353
• InChiKey: ZBJGUTPJDSWGDI-UHFFFAOYSA-N

物化性质

• 沸点：
  335.8±12.0 °C(Predicted)
• 密度：
  1.003±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  18
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.53
• 拓扑面积：
  29.5
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  t-butyl benzyl(propyl)carbamate 在 盐酸 作用下， 以 1,4-二氧六环 、 二氯甲烷 为溶剂， 反应 14.0h， 生成 N-丙基-N-苄胺盐酸盐
  参考文献：
  名称：

  An efficient sequence for the preparation of small secondary amine hydrochloride salts for focused library generation without need for distillation or chromatographic purification

  摘要：

  Collections of small secondary amines for compound library generation can be efficiently prepared by amide reduction using BH(3)-THF or Red-Al followed by brief methanolysis, trapping with di-tert-butyl dicarbonate, and deprotection with 4M HCl in dioxane. The sequence requires no chromatography or distillation and provides multi-gram quantities of pure HCl salts in a short time.

  DOI：

  10.1016/j.bmcl.2004.04.014
• 作为产物：
  描述：

  tert-butyl N-allyl-N-benzylcarbamate 在 TMSB 、 钯 氢气 作用下， 以 乙醇 为溶剂， 20.0 ℃ 、101.32 kPa 条件下， 反应 30.0h， 以98%的产率得到t-butyl benzyl(propyl)carbamate
  参考文献：
  名称：

  Hydrogenation versus hydrogenolysis with a safe, selective and reusable catalyst: palladium black on Teflon®

  摘要：

  铂黑沉积是通过还原和金属化磁力搅拌棒的聚四氟乙烯表面获得的。这些搅拌棒可用于选择性氢化烯烃和炔烃化合物，而不观察到氢解反应。

  DOI：

  10.1039/b501096a

文献信息

• Alpha-Oxidation of Amine Derivatives by bis(2,2,2-Trichloroethyl) Azodicarboxylate and Application of Its Products as Iminium Ion Equivalents
  作者：Shinobu Honzawa、Takumichi Sugihara、Mitsuaki Uchida、Takuya Tashiro

  DOI：10.3987/com-16-s(s)70

  日期：——

  Alpha-oxidation of amine derivatives by azodicarboxylate was examined. Among several azodicarboxylate esters and amides tested, bis(2,2,2-trichloroethyl) azodicarboxylate, that has highly electrophilic 2,2,2-trichloroethoxycarbonyl functional groups, was found to have excellent oxidation reactivity. Acylated or carbamoylated amines were suitable substrates for this reaction condition. Tertially amines could react in the same manner, but spontaneous elimination of hydrazinyl group occurred to give dimerized products. The reaction products were found to react with nucleophiles in the presence of Lewis or Bronsted acid catalyst. This strongly suggests that the reaction products, alpha-hydrazinated amine derivatives, might serve as carbonyl group equivalents, very useful intermediates in synthetic organic chemistry.
• [EN] AMINO ACID HYDROXYETHYLAMINO SULFONAMIDE RETROVIRAL PROTEASE INHIBITORS<br/>[FR] HYDROXYETHYLAMINO SULFONAMIDE A AMINOACIDE AGISSANT COMME INHIBITEURS DE PROTEASES RETROVIRALES
  申请人：G.D. SEARLE & CO.

  公开号：WO1996028463A1

  公开（公告）日：1996-09-19

  (EN) Selected amino acid hydroxyethylamino sulfonamide compounds of formula (I) are effective as retroviral protease inhibitors, and in particular as inhibitors of HIV protease. The present invention relates to such retroviral protease inhibitors and, more particularly, relates to selected novel compounds, composition and method for inhibiting retroviral proteases, such as human immunodeficiency virus (HIV) protease, prophylactically preventing retroviral infection or the spread of a retrovirus, and treatment of a retroviral infection.(FR) L'invention porte sur des composés sélectionnés du type hydroxyéthylamino sulfonamide à aminoacide de formule (I) s'avérant efficaces comme inhibiteurs de protéases rétrovirales et notamment de celle du VIH et plus particulièrement sur de nouveaux composés, compositions et procédés d'inhibition des protéases rétrovirales telle que celle du VIH, de prévention prophylactique et de traitement des infections rétrovirales, et de prévention de la dissémination des rétrovirus.
• An efficient sequence for the preparation of small secondary amine hydrochloride salts for focused library generation without need for distillation or chromatographic purification
  作者：Gene M. Dubowchik、Jodi A. Michne、Dmitry Zuev

  DOI：10.1016/j.bmcl.2004.04.014

  日期：2004.6

  Collections of small secondary amines for compound library generation can be efficiently prepared by amide reduction using BH(3)-THF or Red-Al followed by brief methanolysis, trapping with di-tert-butyl dicarbonate, and deprotection with 4M HCl in dioxane. The sequence requires no chromatography or distillation and provides multi-gram quantities of pure HCl salts in a short time.
• Hydrogenation versus hydrogenolysis with a safe, selective and reusable catalyst: palladium black on Teflon®
  作者：Damien Belotti、Guillaume Cantagrel、Catherine Combellas、Janine Cossy、Frédéric Kanoufi、Sandra Nunige

  DOI：10.1039/b501096a

  日期：——

  Palladium black deposit is obtained by reduction and metallization of the Teflon® polymer surface of magnetic stirring bars. These stirring bars can be used to perform selective hydrogenation of olefins and acetylenic compounds whilst hydrogenolysis is not observed.

  铂黑沉积是通过还原和金属化磁力搅拌棒的聚四氟乙烯表面获得的。这些搅拌棒可用于选择性氢化烯烃和炔烃化合物，而不观察到氢解反应。