CAS: 25493-16-7; 1-Iodopropane-3,3,3-D3

该化合物是一种脱硫的烷基碘化合物,其末端甲基组的三种氢原子被除化,这种同位素标签提高了其在NMR光谱和质谱测量中的用途,为精确的结构分析提供了不同的光谱特征;该化合物是有机合成中有价值的试剂,特别是在脱化子集成研究和机械学研究中;其高同位素纯度确保动能和代谢研究中尽量减少干扰;碘原子的存在也有利于核细胞替代反应,使其在制备脱污衍生物时成为多用途中间体;对于需要稳定的同位素标签的研究应用来说,是合适的.

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CAS号61844-01-7 丙醇-D3

合成工艺路线路线简述

  • 合成目标产物 1-Iodopropane-3,3,3-D3 主要起始原料 Propyl-3,3,3-D3 Alcohol
  • (文献来源)合成步骤主要原料 Propyl-3,3,3-D3 Alcohol
📜丙醇-D3置于碘体系中,化学反应生成碘代丙烷-D3
参考文献:Unimolecular Reactions Of Isolated Organic Ions: The Chemistry Of The Oxonium Ions Ch3Ch2Ch2Ch2+o = Ch2 And Ch3Ch2Ch2Ch = O+ch3
标题:Unimolecular Reactions Of Isolated Organic Ions: The Chemistry Of The Oxonium Ions Ch3Ch2Ch2Ch2+o = Ch2 And Ch3Ch2Ch2Ch = O+ch3
摘要:Abstractthe Reactions Of The Metastable Oxonium Ions Ch3Ch2Ch2Ch2+o = Ch2 And Ch3Ch2Ch2 = O+ Ch3 Are Reported And Discussed. Both These Isomers Of C5H11O+ Expel Predominantly Ch2O (75-90% Of The Metastable Ion Current),A Moderate Amount Of C3H6 (5-15%),A Minor Amount Of Ch3Oh (2-8%) And A Very Small Proportion Of H2O (0.5-3%). All These Processes Give Rise To Gaussian Metastable Peaks. The Kinetic Energy Releases Associated With Fragmentation Of These Oxonium Ions Are Similar,But Slightly Larger For Dissociation Of Ch3Ch2Ch2Ch = O+ch3. The Behaviour Of Labelled Analogues Confirm That The Reactions Of Ch3Ch2Ch2Ch = O+ch3 Are Closely Related,But Subtly Different. Elimination Of Ch2O And C3H6 Is Intelligible By Means Of Mechanisms Involving Ch3Ch+ch2Ch2och3. This Open‐chain Cation Is Accessible To Ch3Ch2Ch2 +o = Ch2 By A 1,5‐h Shift And To Ch3Ch2Ch2‐ch = O+ch3 By Two Consecutive 1,2‐h Shifts (Or,Possibly,A Direct 1,3‐h Shift). The Rates Of These 1,2‐,1,3‐ And 1,5‐h Shifts Are Compared With One Another And Also With The Rates Of Ch2O And C3H6 Loss From Each Of The Two Oxonium Ions. The 1,5‐h Shift That Converts Ch3Ch+ch2Ch2och3 Formed From Ch3Ch2Ch2Ch = O+ Ch3 Into Ch3Ch2Ch2+o = Ch2 Prior To Ch2O Elimination Is Essentially Unidirectional. In Contrast,The Corresponding Step Converting C5H11O+ Ions Generated As Ch3Ch2Ch2Ch2+o = Ch2 Into Ch3Ch+ Ch2Ch2och3 Competes Effectively With Expulsion Of Ch2O And C3H6. The Implications Of The Latter Finding For The Degree Of Concert In The Hydrogen Transfer And Carbon‐carbon Bond Fission Steps In Alkene Losses From Oxonium Ions Via Routes That Are Formally Isoelectronic With The Retro 'ene' Pericyclic Process Are Emphasized.
Doi:10.1002/oms.1210281035

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