(E)-3,7-二甲基-6-氧代-2-辛烯醛 | 70856-12-1

• 分子结构分类: 有机化合物 - 有机氧化合物
• 中文名称: (E)-3,7-二甲基-6-氧代-2-辛烯醛
• 英文名称: (E)-3,7-dimethyl-6-oxo-2-octenal
• 英文别名: 3,7-dimethyl-6-oxo-2-heptenal；(E)-3,7-dimethyl-6-oxo-oct-2-enal；6-oxo-6,7-dihydro-geranial；(E)-3,7-dimethyl-6-oxooct-2-enal
• CAS: 70856-12-1
• 化学式: C₁₀H₁₆O₂
• 分子量: 168.236
• InChiKey: IFVYMLNTGVXBOY-RMKNXTFCSA-N

物化性质

• 沸点：
  291.1±23.0 °C(Predicted)
• 密度：
  0.925±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.8
• 重原子数：
  12
• 可旋转键数：
  5
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.6
• 拓扑面积：
  34.1
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  (E)-3,7-二甲基-6-氧代-2-辛烯醛 以 甲苯 为溶剂， 反应 49.08h， 生成 huajiaosimuline
  参考文献：
  名称：

  Total Syntheses of Pyranoquinoline Alkaloids:  Simulenoline, Huajiaosimuline, and (±)-7-Demethoxyzanthodioline

  摘要：

  DOI：

  10.1021/jo001368h
• 作为产物：
  描述：

  3,7-dimethyl-2E-octen-1,6-diol 在 戴斯-马丁氧化剂 作用下， 以 二氯甲烷 为溶剂， 反应 0.5h， 以92%的产率得到(E)-3,7-二甲基-6-氧代-2-辛烯醛
  参考文献：
  名称：

  Total Syntheses of Pyranoquinoline Alkaloids:  Simulenoline, Huajiaosimuline, and (±)-7-Demethoxyzanthodioline

  摘要：

  DOI：

  10.1021/jo001368h

文献信息

• Thermal Degradation of Terpenes:  Camphene, Δ³-Carene, Limonene, and α-Terpinene
  作者：Gerald W. McGraw、Richard W. Hemingway、Leonard L. Ingram,、Catherine S. Canady、William B. McGraw

  DOI：10.1021/es9810641

  日期：1999.11.1

  Emissions from wood dryers have been of some concern for a number of years, and recent policy changes by the Environmental Protection Agency have placed emphasis upon the gaseous emissions that lead to the formation of particulate matter as small as 2.5 mu m diameter. in this qualitative study, camphene, Delta(3)-carene, limonene, and alpha-terpinene were thermally degraded in the presence of air to determine the number and kind of oxidative degradation products that might be expected under drying conditions used in processing wood products. Various chromatographic methods were used to isolate the products far proof of structure by NMR and/or GC-MS. The degradation products resulted from dehydrogenations, epoxidations, double bond cleavages, allylic oxidations, and rearrangements. A number of compounds not previously associated with the thermal degradation of these terpenes were identified.
• Griesbaum, Karl; Mertens, Henri; Jung, In Chang, Canadian Journal of Chemistry, 1990, vol. 68, # 8, p. 1369 - 1375
  作者：Griesbaum, Karl、Mertens, Henri、Jung, In Chang

  DOI：——

  日期：——
• ——
  作者：O. I. Yarovaya、O. V. Salomatina、D. V. Korchagina、M. P. Polovinka、V. A. Barkhash

  DOI：10.1023/a:1022501815715

  日期：——

  The transformations of 6,7-epoxy derivatives of widely spread in the nature unsaturated aldehydes, citral and citronellal, in various acidic media both under conditions of homogeneous and heterogeneous catalysis were investigated. A number of previously unknown products belonging to different classes of organic compounds was obtained. Probable mechanisms of the products formation are discussed.
• GRIESBAUM, KARL;MERTENS, HENRI;JUNG, CHAM IN, CAN. J. CHEM., 68,(1990) N, C. 1369-1375
  作者：GRIESBAUM, KARL、MERTENS, HENRI、JUNG, CHAM IN

  DOI：——

  日期：——
• METHODS AND COMPOSITIONS FOR ENHANCING HEALTH
  申请人：Ojai Energetics PBC

  公开号：EP3600271A1

  公开（公告）日：2020-02-05