1-Acetyl-4-methyl-2,6-dimethoxy-benzol | 31405-67-1

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 1-Acetyl-4-methyl-2,6-dimethoxy-benzol
• 英文别名: 1-(2,6-dimethoxy-4-methyl-phenyl)-ethanone；1-(2,6-Dimethoxy-4-methyl-phenyl)-aethanon；2,6-Dimethoxy-4-methylacetophenon；1-(2,6-dimethoxy-4-methylphenyl)ethanone
• CAS: 31405-67-1
• 化学式: C₁₁H₁₄O₃
• 分子量: 194.23
• InChiKey: PUIITOIZOJBGGN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  14
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  35.5
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1-Acetyl-4-methyl-2,6-dimethoxy-benzol 在 dimethyl sulfide borane 、 对甲苯磺酸 、 对苯二酚 作用下， 以 四氢呋喃 、 乙醚 、 苯 为溶剂， 反应 6.5h， 生成 2-(2,6-dimethoxy-4-methylphenyl)propan-1-ol
  参考文献：
  名称：

  Lipase-mediated resolution of substituted 2-aryl-propanols: application to the enantioselective synthesis of phenolic sesquiterpenes

  摘要：

  A comprehensive study of the lipase-mediated resolution of substituted 2-aryl-propanols is reported. The latter alcohols were submitted to the irreversible acetylation catalyzed either by PPL, CRL, or lipase PS. The enantioselectivity of these transformations was dependent on the type of lipase used. The type of substituents and particularly their position on the aromatic ring strongly affected the selectivity of the reaction. The experiments described prove that PPL is the more versatile lipase catalyzing the acetylation with an enantiomeric ratio (E) value that ranges from 1 up to 144, depending on the substrate used. Conversely, the same transformations were catalyzed by CRL and lipase PS with an enantiomeric ratio value, which is always less than 5. The remarkable behavior of PPL was exploited in the large scale resolution of some substituted 2-aryl-propanols whose enantiomeric forms are relevant building blocks in the enantioselective synthesis of phenolic sesquiterpenes. By these means, the synthesis of (S)-turmeronol B and the formal syntheses of (R)-curcumene, (R)-curcuphenol, (R)-xanthorrhizol, and (R)-curcuhydroquinone were accomplished. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetasy.2011.03.012
• 作为产物：
  描述：

  3,5-二甲氧基甲苯 、 乙酰氯 在 二硫化碳 、 三氯化铝 作用下， 生成 1-Acetyl-4-methyl-2,6-dimethoxy-benzol
  参考文献：
  名称：

  Tambor, Chemische Berichte, 1908, vol. 41, p. 796

  摘要：

  DOI：

文献信息

• Modulators Of HEC1 Activity And Methods Therefor
  申请人：Lau Johnson

  公开号：US20110230486A1

  公开（公告）日：2011-09-22

  Compounds, compositions, and methods for modulation of Hec1/Nek2 interaction are provided. Especially preferred compounds disrupt Nek2/Hec1 binding and are therefore useful as chemotherapeutic agent for neoplastic diseases.

  提供了用于调节Hec1/Nek2相互作用的化合物、组合物和方法。特别偏爱的化合物会破坏Nek2/Hec1的结合，因此可用作肿瘤疾病的化疗药物。
• Über die Reaktion von 3,5-Diacetyl-2,6-dimethyl-4H-pyran-4-on mit Natriumalkanolaten
  作者：Fritz Eiden、Ernst-Günther Teupe

  DOI：10.1002/ardp.19813140307

  日期：——

  Die Reaktion von 3,5‐Diacetyl‐2,6‐dimethyl‐4H‐pyran‐4‐on (10) mit Natriummethanolat bzw. ‐ethanolat führt zu den 1‐Acetyl‐2‐hydroxy‐4‐methyl‐6‐alkoxybenzolen 11a und 11b.

  3,5-二乙酰-2,6-二甲基-4H-吡喃-4-酮 (10) 与甲醇钠或乙醇钠反应生成 1-乙酰基-2-羟基-4-甲基-6-烷氧基苯 11a 和11b.
• MODULATORS OF HEC1 ACTIVITY AND METHODS THEREFOR
  申请人：Taivex Therapeutics, Inc.

  公开号：US20150057281A1

  公开（公告）日：2015-02-26

  Compounds, compositions, and methods for modulation of Hec1/Nek2 interaction are provided. Especially preferred compounds disrupt Nek2/Hec1 binding and are therefore useful as chemotherapeutic agent for neoplastic diseases.

  提供了调节Hec1/Nek2相互作用的化合物、组合物和方法。特别优选的化合物破坏Nek2/Hec1结合并因此可用作肿瘤疾病的化疗药物。
• [EN] COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH LPA RECEPTOR ACTIVITY<br/>[FR] COMPOSÉS ET COMPOSITIONS POUR TRAITER DES ÉTATS PATHOLOGIQUES ASSOCIÉS À L'ACTIVITÉ DU RÉCEPTEUR LPA
  申请人：LHOTSE BIO INC

  公开号：WO2022083703A1

  公开（公告）日：2022-04-28

  This disclosure relates to LPA antagonists of Formula (I) : including pharmaceutically acceptable salts and solvates thereof, and pharmaceutical compositions including the same.

  该披露涉及LPA拮抗剂的公式(I)：包括其药物可接受的盐和溶剂，以及包括这些盐和溶剂的药物组合物。
• Hattori, Acta Phytochimica, 1928, vol. 4, p. 44,52
  作者：Hattori

  DOI：——

  日期：——