pentyl | 2672-01-7

• 分子结构分类: 有机化合物 - 碳氢化合物 - 饱和烃
• 英文名称: pentyl
• 英文别名: n-Pentyl-Radikal；Pentyl-(1)-Radikal；1-Pentyl-Radikal；Pentylradikal；n-Pentyl
• CAS: 2672-01-7
• 化学式: C₅H₁₁
• 分子量: 71.1423
• InChiKey: BFKVXNPJXXJUGQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  5
• 可旋转键数：
  2
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.8
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为反应物：
  描述：

  pentyl 在 ammonium acetate 、 溶剂黄146 作用下， 以 甲醇 、 甲苯 为溶剂， 反应 26.0h， 生成 2-cyano-2-((E)-5-((E)-4-(dimethylamino)styryl)-2,3-dihydro-1H-inden-1-ylidene)-N-pentylacetamide
  参考文献：
  名称：

  用于检测阿尔茨海默病中淀粉样蛋白-β聚集体的茚满荧光探针的合成和生物学评价

  摘要：

  在本文中，描述了用于检测阿尔茨海默病 (AD) 相关蛋白聚集体的荧光成像探针的开发。设计并合成了具有供体-π-受体（D-π-A）结构的茚满衍生物。对探针与 β-淀粉样蛋白 (Aβ) 蛋白聚集体结合的能力进行了评估，β-淀粉样蛋白聚集体是 AD 的一个关键病理标志。结果表明，与 Aβ 单体形式相比，几种探针与 Aβ 聚集体结合时，在波长大于 600 nm 时表现出显着的荧光强度变化。在测试的探针中，四种 D-π-A 型茚满衍生物对 Aβ 聚集体表现出优于牛血清白蛋白 (BSA) 等非特异性蛋白质的良好结合选择性。分子对接研究表明，我们的化合物通过疏水隧道结构沿着 A β原纤维轴正确定位。进一步分析表明，以二甲氨基吡啶基为选举供体、二氰基为电子受体的最活性化合物可有效对AD转基因小鼠脑组织样本中的Aβ斑块进行染色。这些发现表明，我们的茚满基化合物有潜力作为荧光探针，用于检测和监测 AD 中 Aβ

  DOI：

  10.1016/j.bmc.2023.117513
• 作为产物：
  描述：

  二(己酰)过氧化物 以 甲苯 为溶剂， 生成 pentyl
  参考文献：
  名称：

  使用电子自旋共振光谱研究伯烷基和芳烷基自由基，中间忽略差分重叠计算

  摘要：

  DOI：

  10.1021/j100234a018

文献信息

• Factors Affecting the Rates of Addition of Free Radicals to AlkenesDetermination of Absolute Rate Coefficients Using the Persistent Aminoxyl Method
  作者：Athelstan L. J. Beckwith、James S. Poole

  DOI：10.1021/ja025730g

  日期：2002.8.1

  The rate of coupling of alkyl radicals with the persistent aminoxyl radical 1,1,3,3-tetramethylisoindolin-N-oxyl (1) has been used as a kinetic probe to determine absolute rate coefficients for the addition of alkyl radicals to methyl acrylate. The results are discussed in terms of the role of the structure and functionalization of the attacking radical on the rates of addition, particularly as they

  烷基自由基与持久性氨氧基自由基 1,1,3,3-四甲基异吲哚啉-N-氧基 (1) 的偶联速率已被用作动力学探针，以确定烷基自由基添加到丙烯酸甲酯的绝对速率系数。根据攻击自由基的结构和官能化对添加速率的作用讨论结果，特别是当它们影响空间、极性和焓因子时。氨酰方法与其他确定自由基添加速率系数的方法进行了比较。
• Absolute rate constants for the reaction of triethylsilyl radicals with organic halides
  作者：C. Chatgilialoglu、K. U. Ingold、J. C. Scaiano

  DOI：10.1021/ja00383a022

  日期：1982.9
• Formation and homolysis of organonickel(III) complexes
  作者：Douglas G. Kelley、Adam Marchaj、Andreja Bakac、James H. Espenson

  DOI：10.1021/ja00020a020

  日期：1991.9

  The reactions of Ni(1,4,8,11-tetraazacyclotetradecane)2+ with alkyl radicals were studied. Data were collected for the R,R,S,S (or beta) and R,R,R,R (or alpha) isomers. The reactions form sigma-bonded organometallic cations, as in the equation NiL2+ + R. + H2O reversible RNiL(H2O)2+. The values of the rate constants for the forward (colligation) and reverse (homolysis) reactions were measured separately by laser flash photolysis techniques with a kinetic probe. The values of k(col) lie in the order CH3 >> primary >> secondary, and just the reverse order applies to k(hom). Thus the equilibrium constants for formation of RNiL(H2O)2+, given by k(col)/k(hom), are most favorable for methyl and least favorable for secondary alkyls. These nickel-alkyl bonds are much weaker than those in corresponding cobalt and chromium complexes. For that reason, values of k(col) vary widely with the nature of R.. Values of k(col) are considerably higher for alpha-Ni(cyclam)2+ than for the beta-isomer, and the reverse order applies to k(hom). Also, the alpha-isomer has the highest equilibrium constant for the formation equilibrium. The kinetic and thermodynamic trends can be rationalized by structural effects.
• On the Removal of Metallic Mirrors by Free Radicals
  作者：Francis Owen Rice、Joan Tweedell

  DOI：10.1002/bbpc.19870911003

  日期：1987.10

  AbstractLarge Radicals can be formed by passing chlorinated organic compounds at pressures of a few ram., through a furnace containing a pellet of sodium and heated to 350–400°C. It seems to us that the only radicals that will remove metallic mirrors (of tellurium or antimony, etc., previously deposited beyond the furnace) are those that can decompose into methyl or ethyl radicals plus an unsaturated molecule, without undergoing any transmigration of atoms.
• Reactions of Atomic Oxygen (3P) with Selected Alkanes
  作者：Akira Miyoshi、Kentaro Tsuchiya、Noboru Yamauchi、Hiroyuki Matsui

  DOI：10.1021/j100095a031

  日期：1994.11

  Rate constants for the reactions of atomic oxygen (P-3) With selected alkanes (C-2-C-6 Straight chain alkanes, C-C6H12, neo-C5H12, and i-C4H10) have been determined directly by a laser photolysis-shock tube-atomic resonance absorption method at high temperatures (850-1250 K). For n-C6H14 and c-C6H12, rate constants have been also determined at lower temperatures (296-400 K) by a laser photolysis-vacuum ultraviolet laser-induced fluorescence method. Present results agree with the TST calculation by Cohen and Westberg [Int. J. Chem. Kinet. 1986, 18, 99] within experimental error limits except for O + c-C6H12 and O + neo-C5H12. The group additivity of the rate constants for different C-H bonds (primary, secondary, and tertiary) is examined and neo-C5H12 and c-C6H12 are found to be good representatives of primary and secondary C-H bonds, respectively, for C-4 and larger alkanes. A trial is made to investigate the J dependence of reactivity of atomic oxygen (P-3(J)) With c-C6H12 to examine the adiabatic correlation of reactants and products. No evidence for such J dependence can be observed due to the rapid relaxation among the spin-orbit components. Rate constants for the intratriplet relaxation processes are evaluated for He as a collision partner.