bis(α-hydroxytridecyl) peroxide

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: bis(α-hydroxytridecyl) peroxide
• 英文别名: 1-(1-Hydroxytridecylperoxy)tridecan-1-ol；1-(1-hydroxytridecylperoxy)tridecan-1-ol
• 化学式: C₂₆H₅₄O₄
• 分子量: 430.712
• InChiKey: PZLYLAZSFCPDKB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11.3
• 重原子数：
  30
• 可旋转键数：
  25
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  58.9
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  1-十四烯 在 水 、 臭氧 作用下， 生成 α-hydroxytridecyl hydroperoxide 、 bis(α-hydroxytridecyl) peroxide
  参考文献：
  名称：

  Effect of Relative Humidity on the Chemical Composition of Secondary Organic Aerosol Formed from Reactions of 1-Tetradecene and O₃

  摘要：

  The chemical composition of secondary organic aerosol formed in an environmental chamber from ozonolysis of 1-tetradecene in humid and dry air was determined using a thermal desorption particle beam mass spectrometer (TDPBMS). The major products are alpha-hydroxytridecyl hydroperoxide and bis(alpha-hydroxytridecyl) peroxide in humid air and symmetric C26 and asymmetric C14 secondary ozonides in dry air. The hydroperoxide is formed by reaction of stabilized Criegee biradicals with water vapor, and the peroxide (a peroxyhemiacetal) is formed by subsequent reaction of the hydroperoxide with tridecanal. The secondary ozonides are formed by reactions of stabilized Criegee biradicals with tridecanal and formaldehyde. Tridecanoic acid was also observed in both experiments. These compounds have very low vapor pressures and are stable on the 3-h time scale of the environmental chamber experiments. When collected aerosol was analyzed by gas chromatography, the hydroperoxides, peroxides, and secondary ozonides thermally decomposed to more volatile compounds, including tridecanal, tridecanoic acid, and a few unidentified products.

  DOI：

  10.1021/es991057s

文献信息

• Effect of Relative Humidity on the Chemical Composition of Secondary Organic Aerosol Formed from Reactions of 1-Tetradecene and O₃
  作者：Herbert J. Tobias、Kenneth S. Docherty、Derek E. Beving、Paul J. Ziemann

  DOI：10.1021/es991057s

  日期：2000.6.1

  The chemical composition of secondary organic aerosol formed in an environmental chamber from ozonolysis of 1-tetradecene in humid and dry air was determined using a thermal desorption particle beam mass spectrometer (TDPBMS). The major products are alpha-hydroxytridecyl hydroperoxide and bis(alpha-hydroxytridecyl) peroxide in humid air and symmetric C26 and asymmetric C14 secondary ozonides in dry air. The hydroperoxide is formed by reaction of stabilized Criegee biradicals with water vapor, and the peroxide (a peroxyhemiacetal) is formed by subsequent reaction of the hydroperoxide with tridecanal. The secondary ozonides are formed by reactions of stabilized Criegee biradicals with tridecanal and formaldehyde. Tridecanoic acid was also observed in both experiments. These compounds have very low vapor pressures and are stable on the 3-h time scale of the environmental chamber experiments. When collected aerosol was analyzed by gas chromatography, the hydroperoxides, peroxides, and secondary ozonides thermally decomposed to more volatile compounds, including tridecanal, tridecanoic acid, and a few unidentified products.