n-Propyl-o-Chlorophenol

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: n-Propyl-o-Chlorophenol
• 英文别名: 2-Chloro-6-propylphenol
• 化学式: C₉H₁₁ClO
• 分子量: 170.639
• InChiKey: XRGVNSZUYDRHJA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  11
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  20.2
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  n-Propyl-o-Chlorophenol 在 lithium hydroxide 、 三氟甲磺酸 、 双氧水 、 lithium tert-butoxide 作用下， 以 四氢呋喃 为溶剂， 反应 3.0h， 生成 (S)-(2-Chloro-4-propionyl-6-propyl-phenoxy)-(4-isopropyl-phenyl)-acetic acid
  参考文献：
  名称：

  Design and Synthesis of α-Aryloxyphenylacetic Acid Derivatives:  A Novel Class of PPARα/γ Dual Agonists with Potent Antihyperglycemic and Lipid Modulating Activity

  摘要：

  The synthesis and structure-activity relationships of novel series of alpha-aryloxyphenylacetic acids as PPARalpha/gamma dual agonists are reported. The initial search for surrogates of the ester group in the screen lead led first to the optimization of a subseries with a ketone moiety. Further efforts to modify the ketone subseries led to the design and synthesis of two new subseries containing fused heterocyclic ring systems. All these analogues were characterized by their "super" PPARalpha agonist activity and weak or partial agonist activity on PPARgamma in PPAR-GAL4 transactivation assays despite their similar binding affinities for both receptors. The cocrystal structures of compounds 7 and rosiglitazone with PPARgamma-LBD were compared, and significant differences were found in their interactions with the receptor. Select analogues in each subseries were further evaluated for in vivo efficacy. They all showed excellent anti-hyperglycemic efficacy in a db/db mouse model and hypolipidemic activity in hamster and dog models without provoking the typical PPARgamma-associated side effects in the rat tolerability assay.

  DOI：

  10.1021/jm0502135
• 作为产物：
  描述：

  2-正丙基苯酚 、 氯 生成 n-Propyl-o-Chlorophenol
  参考文献：
  名称：

  WATSON, W. D., J. ORG. CHEM., 1985, 50, N 12, 2145-2148

  摘要：

  DOI：

文献信息

• ACTIVE DELIVERY SYSTEMS FORMULATIONS
  申请人：HOMOLA Andrew M.

  公开号：US20100040565A1

  公开（公告）日：2010-02-18

  The present invention relates to active delivery system formulations, and methods of making and using the same. Said formulations, when applied to a substrate surface, form a protective coating on the surface and permit constituent active agents to act on the surface and in the surrounding medium.

  本发明涉及活性传递系统配方，以及制备和使用这些配方的方法。当这些配方应用到基底表面时，在表面形成一层保护性涂层，并允许组分活性剂在表面和周围介质中起作用。
• Methods, compositions, and dental delivery systems for the protection of the surfaces of teeth
  申请人：HOMOLA, Andrew M.

  公开号：EP1486197A2

  公开（公告）日：2004-12-15

  The present invention discloses applicators containing cationic surface active agents, hydrophobic barrier-forming materials and antimicrobial compounds which form, upon application to dental surfaces, a protective and bacteria-inhibiting film.

  本发明公开了含有阳离子表面活性剂、疏水屏障形成材料和抗菌化合物的涂抹器，涂抹到牙齿表面后，可形成一层保护和抑菌膜。
• Multi functional oral care chewing gum possessing tooth cleaning effects
  申请人：Gumlink A/S

  公开号：EP1688162A1

  公开（公告）日：2006-08-09

  A chewing gum possessing tooth cleaning effects, which chewing gum includes at least gum base and: a) at least one active cosmetic ingredient selected from whitening agents, b) at least one active cosmetic ingredient selected from fresh-breath agents, c) at least one active therapeutic ingredient selected from anti-plaque agents, d) at least one active therapeutic ingredient selected from anti-gingivitis agents. The chewing gum is intended for round the year daily use as the major tooth cleaning agent.

  一种具有牙齿清洁效果的口香糖，该口香糖至少包括口香糖基质和：a) 至少一种选自美白剂的活性化妆品成分；b) 至少一种选自清新口气剂的活性化妆品成分；c) 至少一种选自抗牙菌斑剂的活性治疗成分；d) 至少一种选自抗牙龈炎剂的活性治疗成分。该口香糖可作为主要的牙齿清洁剂全年每天使用。
• Multi functional oral care chewing gum
  申请人：Gumlink A/S

  公开号：EP1685875A1

  公开（公告）日：2006-08-02

  The present invention relates to a chewing gum possessing tooth cleaning effects, comprising gum base, at least one first active cosmetic ingredient selected from whitening agents, at least one second active cosmetic agent selected from fresh-breath agents, and at least three active therapeutic ingredients providing at least three of the following effects: anti-plaque effect, anti-gingivitis effect, anti-calculus effect, and/or re-mineralization effect.

  本发明涉及一种具有牙齿清洁效果的口香糖，包括口香糖基质、至少一种选自美白剂的第一活性化妆品成分、至少一种选自清新口气剂的第二活性化妆品成分，以及至少三种提供以下效果中至少三种效果的活性治疗成分：抗牙菌斑效果、抗牙龈炎效果、抗牙结石效果和/或再矿化效果。
• A kit for cleaning teeth by chewing of a set of chewing gum pieces
  申请人：Gumlink A/S

  公开号：EP1693085A1

  公开（公告）日：2006-08-23

  A kit for cleaning teeth by simultaneously or sequentially chewing a set of chewing gum pieces, the individual chewing gum piece included in the set comprising gum base and one or more of the following ingredients: at last one whitening agent, at least one fresh-breath agent, at least one anti-plaque agent or anti-gingivitis agent, and optionally at least one re-mineralization agent.

  一种通过同时或依次咀嚼一组口香糖片来清洁牙齿的套装，套装中的单个口香糖片包括胶基和以下一种或多种成分：至少一种美白剂、至少一种清新口气剂、至少一种抗牙菌斑剂或抗牙龈炎剂，以及可选的至少一种再矿化剂。