2-hydroxy-3-isopropyl-6-methyl-benzenesulfonic acid

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: 2-hydroxy-3-isopropyl-6-methyl-benzenesulfonic acid
• 英文别名: 2-Hydroxy-3-isopropyl-6-methyl-benzolsulfonsaeure；6-Thymol-sulfonsaeure；2-hydroxy-6-methyl-3-propan-2-ylbenzenesulfonic acid
• 化学式: C₁₀H₁₄O₄S
• 分子量: 230.285
• InChiKey: VOPUYESTUDFQCK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.4
• 重原子数：
  15
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  83
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  硫酸 、 2-hydroxy-3-isopropyl-6-methyl-benzenesulfonic acid 生成 4-羟基-2-甲基-5-(1-甲基乙基)-苯磺酸
  参考文献：
  名称：

  Claus; Krause, Journal fur praktische Chemie (Leipzig 1954), 1891, vol. <2> 43, p. 348

  摘要：

  DOI：
• 作为产物：
  描述：

  百里酚 在 硫酸 作用下， 生成 2-hydroxy-3-isopropyl-6-methyl-benzenesulfonic acid
  参考文献：
  名称：

  Claus; Krause, Journal fur praktische Chemie (Leipzig 1954), 1891, vol. <2> 43, p. 348

  摘要：

  DOI：

文献信息

• ESSENTIAL OIL DERIVATIVES, THEIR PREPARATION AND USES
  申请人：GASPERONI Giovanni

  公开号：US20180265804A1

  公开（公告）日：2018-09-20

  Compounds are described which are derivatives of essential oils, functionalized in order to improve their antibacterial, antiprotozoal and antiviral activity, reduce their volatility and modify their solubility in certain solvents, particularly water. Additionally, also the palatability has been significantly improved with respect to the starting essential oils. These compounds are designed 5 to be used as food ingredients in food products for nutritional purposes and extra-nutritional (as prebiotics) purposes, in both human and animal feed industries, even if these compounds can be successfully used also in cosmetics, detergents and for the control of the microbial load in general.

  描述了一些衍生自精油的化合物，经过官能化以提高其抗菌、抗原虫和抗病毒活性，降低其挥发性并改变其在特定溶剂中（尤其是水中）的溶解性。此外，相较于起始精油，这些化合物的口感也得到了显著改善。这些化合物被设计用作食品中的食品成分，用于营养目的和额外营养（作为益生元）目的，无论是在人类还是动物饲料行业中，即使这些化合物也可以成功用于化妆品、洗涤剂和一般微生物负载控制。
• [EN] ESSENTIAL OIL DERIVATIVES, THEIR PREPARATION AND USES<br/>[FR] DÉRIVÉS D'HUILES ESSENTIELLES, LEUR PRÉPARATION ET LEURS UTILISATIONS
  申请人：VOLARE & CONNECTING LLC

  公开号：WO2016185249A1

  公开（公告）日：2016-11-24

  Compounds are described which are derivatives of essential oils, functionalized in order to improve their antibacterial, antiprotozoal and antiviral activity, reduce their volatility and modify their solubility in certain solvents, particularly water. Additionally, also the palatability has been significantly improved with respect to the starting essential oils. These compounds are designed 5 to be used as food ingredients in food products for nutritional purposes and extra-nutritional (as prebiotics) purposes, in both human and animal feed industries, even if these compounds can be successfully used also in cosmetics, detergents and for the control of the microbial load in general.
• Claus; Krause, Journal fur praktische Chemie (Leipzig 1954), 1891, vol. <2> 43, p. 348
  作者：Claus、Krause

  DOI：——

  日期：——