2-(4-Hydroxy-3-methoxyphenyl)-2-propanol | 51941-34-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: 2-(4-Hydroxy-3-methoxyphenyl)-2-propanol
• 英文别名: β-oxy-β-(4-oxy-3-methoxy-phenyl)-propane；β-Oxy-β-(4-oxy-3-methoxy-phenyl)-propan；4.1¹-Dioxy-3-methoxy-1-isopropyl-benzol；4-(2-Hydroxypropan-2-yl)-2-methoxyphenol
• CAS: 51941-34-5
• 化学式: C₁₀H₁₄O₃
• 分子量: 182.219
• InChiKey: FKVFRDXWGCQEGA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.6
• 重原子数：
  13
• 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：
  49.7
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2-(4-Hydroxy-3-methoxyphenyl)-2-propanol 生成 4-(1-methylethyl)-2-methoxyphenol
  参考文献：
  名称：

  Tobacco Smoke Chemistry. 2. Alkyl and Alkenyl Substituted Guaiacols Found in Cigarette Smoke Condensate.

  摘要：

  A series of alkyl and alkenyl substituted guaiacols, which comprise a group of biologically and organoleptically active compounds, have been synthesized. Mass spectra and GC retention times for these have been recorded and compared with those obtained for constituents of a weakly acidic fraction of smoke condensate derived from American blend type cigarettes. On the basis of these results, 25 guaiacols have been identified, 18 of which have not been detected in tobacco smoke condensate previously.

  DOI：

  10.3891/acta.chem.scand.43-0044
• 作为产物：
  描述：

  甲基碘化镁 、 香草酸乙酯 生成 2-(4-Hydroxy-3-methoxyphenyl)-2-propanol
  参考文献：
  名称：

  Behal; Tiffeneau, Bulletin de la Societe Chimique de France, 1908, vol. <4> 3, p. 730

  摘要：

  DOI：

文献信息

• BISPHENOL ALTERNATIVE DERIVED FROM RENEWABLE SUBSTITUTED PHENOLICS AND THEIR INDUSTRIAL APPLICATION
  申请人：WOOL Deborah

  公开号：US20170210689A1

  公开（公告）日：2017-07-27

  A compound is provided according to structure 4, (4) wherein n has a value from 0 to 48 and Z is hydroxyl or a benzene ring bearing substituents R 11 -R 15 , wherein R 1 -R 15 are each individually selected from the group consisting of H, allyl, alkyl, alkoxy, phenyl, phenoxy, halide, hydroxyl, glycidyl, (meth)acryloyl, 3-(meth)acryloyl-2-hydroxy-1-propoxy, 2,3-epoxypropyl, maleate, and structure (a) wherein at least one of R 1 -R 5 , at least one of R 6 -R 10 , and at least one of R 11 -R 15 is hydroxyl or an ether or ester derived from it.

  根据结构4提供了一种化合物，其中n的值为0至48，Z是羟基或带有取代基R11-R15的苯环，其中R1-R15分别从H、烯丙基、烷基、烷氧基、苯基、苯氧基、卤素、羟基、环氧丙基、(甲基)丙烯酰基、3-(甲基)丙烯酰基-2-羟基-1-丙氧基、2,3-环氧丙基、马来酸酯和结构(a)中选择，其中至少一个R1-R5、至少一个R6-R10和至少一个R11-R15是羟基或由其衍生的醚或酯。
• Bisphenol alternative derived from renewable substituted phenolics and their industrial application
  申请人：UNIVERSITY OF DELAWARE

  公开号：US10723684B2

  公开（公告）日：2020-07-28

  A compound is provided according to structure 4, (4) wherein n has a value from 0 to 48 and Z is hydroxyl or a benzene ring bearing substituents R11-R15, wherein R1-R15 are each individually selected from the group consisting of H, allyl, alkyl, alkoxy, phenyl, phenoxy, halide, hydroxyl, glycidyl, (meth)acryloyl, 3-(meth)acryloyl-2-hydroxy-1-propoxy, 2,3-epoxypropyl, maleate, and structure (a) wherein at least one of R1-R5, at least one of R6-R10, and at least one of R11-R15 is hydroxyl or an ether or ester derived from it and one of the R6-R10 groups is replaced by a direct bond to the CXY group.

  根据结构 4 提供了一种化合物，(4)其中 n 的值为 0 至 48，Z 为羟基或带有取代基 R11-R15 的苯环，其中 R1-R15 各自单独选自 H、烯丙基、烷基、烷氧基、苯基、苯氧基、卤化物、羟基、缩水甘油基、(甲基)丙烯酰基、3-(甲基)丙烯酰基-2-羟基-1-丙氧基、2,3-环氧丙基、马来酸盐组成的组、(甲基)丙烯酰基、3-(甲基)丙烯酰基-2-羟基-1-丙氧基、2,3-环氧丙基、马来酸基，以及结构(a)，其中 R1-R5 中的至少一个、R6-R10 中的至少一个和 R11-R15 中的至少一个是羟基或由其衍生的醚或酯，且 R6-R10 中的一个基团被 CXY 基团的直接键取代。
• Pospisek,J. et al., Collection of Czechoslovak Chemical Communications, 1975, vol. 40, p. 142 - 148
  作者：Pospisek,J. et al.

  DOI：——

  日期：——
• [EN] BISPHENOL ALTERNATIVES DERIVED FROM RENEWABLE SUSBSTITUTED PHENOLICS AND THEIR INDUSTRIAL APPLICATION<br/>[FR] ALTERNATIVES AU BISPHÉNOL DÉRIVÉES DE COMPOSÉS PHÉNOLIQUES SUBSTITUÉS RENOUVELABLES ET LEUR APPLICATION INDUSTRIELLE
  申请人：RENO KALEIGH HAVERY

  公开号：WO2015183892A1

  公开（公告）日：2015-12-03

  A compound is provided according to structure 4, wherein n has a value from 0 to 48 and Z is hydroxyl or a benzene ring bearing substituents R11-R15, wherein R1-R15 are each individually selected from the group consisting of H, allyl, alkyl, alkoxy, phenyl, phenoxy, halide, hydroxyl, glycidyl, (meth)acryloyl, 3-(meth)acry!oyl-2-hydroxy-1-propoxy, 2,3-epoxypropyl, maleate, and structure (a) wherein at least one of R1-R5, at least one of R6-R10, and at least one of R11-R15 is hydroxyl or an ether or ester derived from it.
• Tobacco Smoke Chemistry. 2. Alkyl and Alkenyl Substituted Guaiacols Found in Cigarette Smoke Condensate.
  作者：Jan Arnarp、Jacek Bielawski、Britt-Marie Dahlin、Olof Dahlman、Curt R. Enzell、Tore Pettersson、A. M. Mulichak、Tomas Alminger、Magnus Erickson、Inger Grundevik、Inger Hagin、Kurt-Jürgen Hoffman、Svante Johansson、Sam Larsson、Ingalil Löfberg、Kristina Ohlson、Björn Persson、Inger Skånberg、Lija Tekenbergs-Hjelte

  DOI：10.3891/acta.chem.scand.43-0044

  日期：——

  A series of alkyl and alkenyl substituted guaiacols, which comprise a group of biologically and organoleptically active compounds, have been synthesized. Mass spectra and GC retention times for these have been recorded and compared with those obtained for constituents of a weakly acidic fraction of smoke condensate derived from American blend type cigarettes. On the basis of these results, 25 guaiacols have been identified, 18 of which have not been detected in tobacco smoke condensate previously.