1-溴-5-碘戊烷 | 88962-86-1

• 物质功能分类: 有机原料 - 烃类化合物及其衍生物 - 烃类卤化物
• 分子结构分类: 有机化合物 - 有机卤素化合物 - 有机碘化物
• 中文名称: 1-溴-5-碘戊烷
• 中文别名: N-Boc-1-氨基环丙甲酸
• 英文名称: 1-bromo-5-iodopentane
• CAS: 88962-86-1
• 化学式: C₅H₁₀BrI
• 分子量: 276.943
• InChiKey: FWDOLPSHUHIDGX-UHFFFAOYSA-N

物化性质

• 沸点：
  115-118 °C(Press: 12 Torr)
• 密度：
  1.935±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4
• 重原子数：
  7
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

安全信息

• 储存条件：
  室温

反应信息

• 作为反应物：
  描述：

  1-溴-5-碘戊烷 在 叔丁基锂 作用下， 以 乙醚 、 正戊烷 为溶剂， 反应 0.5h， 以98%的产率得到环戊烷
  参考文献：
  名称：

  Reactions of tert-butyllithium with .alpha.,.omega.-dihaloalkanes. Evidence for single-electron-transfer-mediated metal-halogen interchange involving alkyl radical-halide ion adducts

  摘要：

  DOI：

  10.1021/jo00186a004
• 作为产物：
  描述：

  5-溴-1-戊烯 在 硼烷四氢呋喃络合物 、 一氯化碘 作用下， 生成 1-溴-5-碘戊烷
  参考文献：
  名称：

  Reactions of tert-butyllithium with .alpha.,.omega.-dihaloalkanes. Evidence for single-electron-transfer-mediated metal-halogen interchange involving alkyl radical-halide ion adducts

  摘要：

  DOI：

  10.1021/jo00186a004

文献信息

• Cytotoxicity and Antibacterial Evaluation of <i>O</i> ‐Alkylated/Acylated Quinazolin‐4‐one Schiff Bases
  作者：Neha Manhas、Parvesh Singh、Chunderika Mocktar、Moganavelli Singh、Neil Koorbanally

  DOI：10.1002/cbdv.202100096

  日期：2021.5

  (SAR) analysis revealed that O‐alkylation generally increased the anticancer activity and selectivity of quinazoline‐4‐one Schiff bases toward Caco‐2 cells. The fluorinated Schiff‐base generally exhibited even more significant cytotoxic activity compared to their chlorine analogs. Surprisingly, none of the quinazoline‐4‐one Schiff bases displayed encouraging antibacterial activity against the bacterial

  合成了一系列喹唑啉-4-one Schiff 碱，并在体外测试了它们对两种癌细胞系（MCF-7、Caco-2）和一种人胚胎细胞系（HEK-293）的细胞毒性，包括它们对两种癌细胞的抗菌评估。革兰氏阳性和四种革兰氏阴性细菌菌株。大多数喹唑啉-希夫碱对 Caco-2 表现出有效的细胞毒性。3 - [（Ž） - （4 - [（丁-2-炔-1-基）氧基]苯基}亚甲基）氨基] -2-甲基喹唑啉-4（3 H ^） -酮（1207）与所述ø -丁炔官能团显示了三个倍高细胞毒性活性（IC 50相比，5-氟尿嘧啶（5-FU = 376.8μM）; IC 50=1086.1 微米）。然而，所有化合物都被发现对 HEK-293 有毒，除了 3-[( Z )-(4-[(2,4-二氟苯基)甲氧基]苯基}亚甲基)氨基]-2-甲基喹唑啉-4( 3 H )-one ( 6h ) 显示出比 5-FU 低约三倍的毒性和更高的选择性指数。构效关系
• Kuchin, A. V.; Nurushev, R. A.; Tolstikov, G. A., Journal of general chemistry of the USSR, 1983, vol. 53, p. 2271 - 2277
  作者：Kuchin, A. V.、Nurushev, R. A.、Tolstikov, G. A.

  DOI：——

  日期：——
• Structure−Activity Relationships of Cyclopropene Compounds, Inhibitors of Pheromone Biosynthesis in <i>Bombyx mori</i>
  作者：Tetsu Ando、Ryuta Ohno、Kazuhisa Ikemoto、Masanobu Yamamoto

  DOI：10.1021/jf950757n

  日期：1996.1.1

  According to the synthetic route for 11,12-methylenehexadec-11-enoic acid [10-(2-butyl-1-cyclopropenyl)decanoic acid] and the amide, their related cyclopropene compounds, which possessed a propene ring at the 7,8-, 9,10-, or 13,14-position in a C-16 chain and the 11,12-position in a C-14 or C-18 chain, were synthesized via the corresponding 1-alkyl-1,2,2-tribromocyclopropane. Their activities as biosynthetic inhibitors of bombykol [(10E,12Z)-10,12-hexadecadien-1-ol; sex pheromone of the silkworm moth Bombyx mori L.] were measured with virgin female silkworm moths in vivo. The 7,8-methylene compounds were inactive even at the dose of 10 mu g/gland, but other compounds at 1 mu g/gland inhibited the conversion of [16,16, 16-H-2(3)]hexadecanoic acid to bombykol to some extent. Each amide showed stronger inhibitory activity than the corresponding acid, and the 11,12-methylene amide with a C-16 chain was the strongest (I-50 = 0.016 mu g/gland) among the tested compounds. Furthermore, experiments comparing the incorporation of [1-C-14]hexadecanoic acid into bombykol and another alcohol component in the pheromone gland, (Z)-11-hexadecen-1-ol, suggested that the all-desaturation was blocked by 9,10- and 11,12-methylene compounds and the subsequent Delta 10,- 12-desaturation by 11,12- and 13,14-methylene compounds.
• KUCHIN, A. V.;NURUSHEV, R. A.;TOLSTIKOV, G. A., ZH. OBSHCH. XIMII, 1983, 53, N 11, 2519-2527
  作者：KUCHIN, A. V.、NURUSHEV, R. A.、TOLSTIKOV, G. A.

  DOI：——

  日期：——
• BAILEY, W. F.;GAGNIER, R. P.;PATRICIA, J. J., J. ORG. CHEM., 1984, 49, N 12, 2098-2107
  作者：BAILEY, W. F.、GAGNIER, R. P.、PATRICIA, J. J.

  DOI：——

  日期：——