3-(1-methylethyl)-6-oxo-2-heptenal | 70856-13-2

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 3-(1-methylethyl)-6-oxo-2-heptenal
• 英文别名: E-3-isopropyl-6-oxo-2-heptenal；(Z)-6-oxo-3-propan-2-ylhept-2-enal
• CAS: 70856-13-2
• 化学式: C₁₀H₁₆O₂
• 分子量: 168.236
• InChiKey: VFTKTCGRHXCEAS-POHAHGRESA-N

物化性质

• 沸点：
  291.1±23.0 °C(predicted)
• 密度：
  0.925±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 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

• 作为产物：
  描述：

  1-hydroperoxy-1-methoxy-3,7-dimethyl-6-oxo-2-octene 在 二甲基硫 作用下， 以 氘代苯 为溶剂， 反应 17.0h， 生成 (E)-3-isopropyl-6-oxo-hept-2-enal 、 3-(1-methylethyl)-6-oxo-2-heptenal
  参考文献：
  名称：

  Griesbaum, Karl; Mertens, Henri; Jung, In Chang, Canadian Journal of Chemistry, 1990, vol. 68, # 8, p. 1369 - 1375

  摘要：

  DOI：

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.
• COMPOSITION OF MONOTERPENOIDS HAVING BACTERICIDAL PROPERTIES
  申请人：Reynolds Max

  公开号：US20140039045A1

  公开（公告）日：2014-02-06

  A composition having bactericidal properties comprising; (a) 30%-80% of at least one compound having the formula (I) and (b) 10% to 40% of at least one compound of formula (II)
• METHODS AND COMPOSITIONS FOR ENHANCING HEALTH
  申请人：Ojai Energetics PBC

  公开号：US20200101041A1

  公开（公告）日：2020-04-02

  Compositions, methods, and kits described herein may be formulated as a nutritional supplement or a dietary supplement. A composition described herein may provide nutrients or compounds that may otherwise not be consumed in sufficient quantities in a normal diet, and may contribute to physical wellbeing and emotional wellbeing of a subject.
• US9023888B2
  申请人：——

  公开号：US9023888B2

  公开（公告）日：2015-05-05
• [EN] COMPOSITIONS OF MONOTERPENOIDS FOR THE TREATMENT OF AN HIV INFECTION<br/>[FR] MÉTHODE POUR LE TRAITEMENT D'UNE INFECTION À VIH
  申请人：REYNOLDS MAX

  公开号：WO2012104567A1

  公开（公告）日：2012-08-09

  The invention concerns use of a composition for the treatment and prophylaxis of an HIV infection in a patient. The composition comprises a mixture of 30% - 80% of at least one compound having the formula (I) and 10% to 40% of at least one compound of the formula (II) wherein the substituents are as defined in the description. The invention also relates to methods for the treatment and prophylaxis of an HIV infection and also use of the composition in the preparation of a medicament for treatment of an HIV infection.