2-methyl-3-hydroxy-2-(4'-methoxyphenyl)propionic acid | 15084-04-5

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 苯丙酸
• 英文名称: 2-methyl-3-hydroxy-2-(4'-methoxyphenyl)propionic acid
• 英文别名: 2-Methyl-3-hydroxy-3-(p-methoxy-phenyl)-propionsaeure；3-Hydroxy-3-(4-methoxyphenyl)-2-methylpropanoic acid
• CAS: 15084-04-5
• 化学式: C₁₁H₁₄O₄
• mdl: MFCD16749542
• 分子量: 210.23
• InChiKey: YNFBEQICUMUBDQ-UHFFFAOYSA-N

物化性质

• 沸点：
  378.7±37.0 °C(Predicted)
• 密度：
  1.218±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  15
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.363
• 拓扑面积：
  66.8
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  2-methyl-3-hydroxy-2-(4'-methoxyphenyl)propionic acid 在 氯化亚砜 作用下， 以 二氯甲烷 、 N,N-二甲基甲酰胺 为溶剂， 生成 3-Chloro-3-(4-methoxy-phenyl)-2-methyl-propionyl chloride
  参考文献：
  名称：

  Galatsis, Paul; Manwell, Jeffrey J.; Blackwell, James M., Canadian Journal of Chemistry, 1994, vol. 72, # 7, p. 1656 - 1659

  摘要：

  DOI：
• 作为产物：
  描述：

  4-甲氧基苯甲醛 、 丙酸 在 lithium diisopropyl amide 作用下， 生成 2-methyl-3-hydroxy-2-(4'-methoxyphenyl)propionic acid
  参考文献：
  名称：

  Galatsis, Paul; Manwell, Jeffrey J.; Blackwell, James M., Canadian Journal of Chemistry, 1994, vol. 72, # 7, p. 1656 - 1659

  摘要：

  DOI：

文献信息

• Ligand-Promoted, Boron-Mediated Chemoselective Carboxylic Acid Aldol Reaction
  作者：Hideoki Nagai、Yuya Morita、Yohei Shimizu、Motomu Kanai

  DOI：10.1021/acs.orglett.6b00914

  日期：2016.5.6

  selective aldol reaction mediated by boron compounds and a mild organic base (DBU) was developed. Inclusion of electron-withdrawing groups in the amino acid derivative ligands reacted with BH3·SMe2 forms a boron promoter with increased Lewis acidity at the boron atom and facilitated the carboxylic acid selective enolate formation, even in the presence of other carbonyl groups such as amides, esters, ketones

  开发了由硼化合物和温和的有机碱（DBU）介导的第一个羧酸选择性羟醛反应。与BH 3 ·SMe 2反应的氨基酸衍生物配体中包含吸电子基团，形成硼促进剂，在硼原子上路易斯酸度增加，即使在存在其他羰基如酰胺，酯，酮或脂族醛。出色的配体效应导致了包括生物相关化合物在内的广泛底物范围。
• Galatsis Paul, Manwell Jeffrey J., Blackwell James M., Can. J. Chem, 72 (1994) N 7, S 1656- 1659
  作者：Galatsis Paul, Manwell Jeffrey J., Blackwell James M.

  DOI：——

  日期：——
• [EN] COMPOSITION AND METHOD FOR COMBATTING PLANT FUNGI, AND PLANT FUNGUS INHIBITING COMPOUNDS<br/>[FR] COMPOSITION ET PROCEDE SERVANT A LUTTER CONTRE DES CHAMPIGNONS DE PLANTES ET COMPOSES INHIBANT CES CHAMPIGNONS
  申请人：GREEN CARE LAB LTD

  公开号：WO2000024251A1

  公开（公告）日：2000-05-04

  A composition for combatting plant fungi, which comprises at least one compound having plant fungus inhibiting activity, said at least one compound being selected from carboxylic acids of the formulae: RX(CHY)nCO2H (I) and RX(CHY)mCONH-Z-CO2H (II) the corresponding lactones and functional derivatives of the carboxylic acid group, where R is an unsubstituted or substituted aromatic nucleus, X is CHOH or CO, n is an integer selected from 1, 2, 3, 4 and 5, m is 1 or 2, each Y is independently H, C1-4 alkyl, C1-4 alkoxy, OH, NH2, halogen, substituted OH or substituted NH2, and Z is the residue of an α-amino carboxylic acid NH2-Z-CO2H, together with at least one compatible diluent, carrier, surface active agent or other adjuvant. The invention includes a method for combatting plant fungi, by applying to the locus thereof at least one compound selected from carboxylic acids of the formulae (I) and (II) and their functional derivatives and lactones, as defined above and some of which are claimed per se.