(4-甲氧基-3-甲基苯基)(苯基)甲醇 | 804499-51-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: (4-甲氧基-3-甲基苯基)(苯基)甲醇
• 中文别名: 苯酚,4-氨基-5-甲氧基-2-甲基-
• 英文名称: (4-methoxy-3-methyl-phenyl)-phenyl-methanol
• 英文别名: 4-Methoxy-3-methylbenzhydrol；(4-Methoxy-3-methylphenyl)(phenyl)methanol；(4-methoxy-3-methylphenyl)-phenylmethanol
• CAS: 804499-51-2
• 化学式: C₁₅H₁₆O₂
• mdl: MFCD13243441
• 分子量: 228.291
• InChiKey: JIURXQALUTZYIQ-UHFFFAOYSA-N

物化性质

• 沸点：
  371.2±30.0 °C(Predicted)
• 密度：
  1.100±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.1
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  29.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  1-甲氧基-1-(三甲基甲硅氧基)-2-甲基-1-丙烯 、 (4-甲氧基-3-甲基苯基)(苯基)甲醇 在 四氯化钛 作用下， 以 二氯甲烷 为溶剂， 反应 2.17h， 以1.154 g的产率得到methyl 3-(4-methoxy-3-methylphenyl)-2,2-dimethyl-3-phenylpropanoate
  参考文献：
  名称：

  Dimethyl-diphenyl-propanamide Derivatives As Nonsteroidal Dissociated Glucocorticoid Receptor Agonists

  摘要：

  A series of 2,2-dimethyl-3,3-diphenyl-propanamides as novel glucocorticoid receptor modulators is reported. SAR exploration led to the identification of 4-hydroxyphenyl propanamide derivatives displaying good agonist activity in GR-mediated transrepression assays and reduced agonist activity in GR-mediated transactivation assays. Compounds 17 and 30 showed anti-inflammatory activity comparable to prednisolone in the rat carrageenan-induced paw edema model, with markedly decreased side effects with regard to increases in blood glucose and expression of hepatic tyrosine aminotransferase. A hypothetical binding mode accounting for the induction of the functional activity by a 4-hydroxyl group is proposed.

  DOI：

  10.1021/jm100957a
• 作为产物：
  描述：

  4-methoxy-3-methylbenzophenone 在 sodium tetrahydroborate 作用下， 以 异丙醇 为溶剂， 生成 (4-甲氧基-3-甲基苯基)(苯基)甲醇
  参考文献：
  名称：

  Mindl,J.; Vecera,M., Collection of Czechoslovak Chemical Communications, 1972, vol. 37, p. 1143 - 1149

  摘要：

  DOI：

文献信息

• One-pot synthesis of aryl butyl tellurides from tellurium tetrachloride and activated aromatics through a solventless step
  作者：Rodrigo L.O.R. Cunha、Álvaro T. Omori、Priscila Castelani、Fabiano T. Toledo、João V. Comasseto

  DOI：10.1016/j.jorganchem.2004.08.041

  日期：2004.11

  A solventless preparation of aryl tellurium trichlorides from activated aromatic compounds avoiding the use of hazardous solvents as carbon tetrachloride and chloroform is described. The trichlorides were reduced and alkylated leading to aryl butyl tellurides in a one-pot procedure. Transmetallation of these tellurides with n-butyllithium followed by reaction with benzaldehyde gave the corresponding benzhydrols in good yields. (C) 2004 Elsevier B.V. All rights reserved.
• Mindl,J.; Vecera,M., Collection of Czechoslovak Chemical Communications, 1972, vol. 37, p. 1143 - 1149
  作者：Mindl,J.、Vecera,M.

  DOI：——

  日期：——
• Dimethyl-diphenyl-propanamide Derivatives As Nonsteroidal Dissociated Glucocorticoid Receptor Agonists
  作者：Bingwei V. Yang、David S. Weinstein、Lidia M. Doweyko、Hua Gong、Wayne Vaccaro、Tram Huynh、Hai-yun Xiao、Arthur M. Doweyko、Lorraine Mckay、Deborah A. Holloway、John E. Somerville、Sium Habte、Mark Cunningham、Michele McMahon、Robert Townsend、David Shuster、John H. Dodd、Steven G. Nadler、Joel C. Barrish

  DOI：10.1021/jm100957a

  日期：2010.12.9

  A series of 2,2-dimethyl-3,3-diphenyl-propanamides as novel glucocorticoid receptor modulators is reported. SAR exploration led to the identification of 4-hydroxyphenyl propanamide derivatives displaying good agonist activity in GR-mediated transrepression assays and reduced agonist activity in GR-mediated transactivation assays. Compounds 17 and 30 showed anti-inflammatory activity comparable to prednisolone in the rat carrageenan-induced paw edema model, with markedly decreased side effects with regard to increases in blood glucose and expression of hepatic tyrosine aminotransferase. A hypothetical binding mode accounting for the induction of the functional activity by a 4-hydroxyl group is proposed.