2-碘-6-甲氧基苯甲醇 | 877265-22-0

• 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: 2-碘-6-甲氧基苯甲醇
• 英文名称: (2-iodo-6-methoxyphenyl)methanol
• CAS: 877265-22-0
• 化学式: C₈H₉IO₂
• 分子量: 264.063
• InChiKey: QXQOLHLWSMNMNM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  11
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  29.5
• 氢给体数：
  1
• 氢受体数：
  2

安全信息

• 海关编码：
  2909499000

反应信息

• 作为反应物：
  描述：

  2-碘-6-甲氧基苯甲醇 在 氢氧化钾 、 碘 、 三苯基膦 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 3.0h， 生成 3-Acetyl-1-(2-iodo-6-methoxy-benzyl)-1H-indole-4-carbaldehyde
  参考文献：
  名称：

  A concise synthesis of 5-demethyl-HKI 0231A and 5-demethyl-HKI 0231B

  摘要：

  The pentacyclic skeleton of HKI 0231A and HKI 0231B was synthesized by a novel radical cyclization/oxidation followed by DDQ oxidation to introduce the methoxyl groups the HKI 0231B series. (c) 2006 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2006.08.065
• 作为产物：
  描述：

  2-氨基-6-甲氧基苯甲酸 在 盐酸 、 硼酸三甲酯 、 dimethyl sulfide borane 、 sodium nitrite 作用下， 以 四氢呋喃 、 水 为溶剂， 反应 8.0h， 生成 2-碘-6-甲氧基苯甲醇
  参考文献：
  名称：

  Palladium-Catalyzed, Norbornene-Mediated, ortho-Amination ipso-Amidation: Sequential C–N Bond Formation

  摘要：

  A palladium-catalyzed, norbornene-mediated ortho- and ipso-C-N bond-forming Catellani reaction is reported. This reaction proceeds through a sequential intermolecular amination followed by intramolecular cyclization of a tethered amide. The products, ortho-aminated dihydroquinolinones, were generated in moderate to good yields and, are present in bioactive, molecules. This work highlights the challenge Of competing intra-vs intermolecular palladium-catalyzed processes.

  DOI：

  10.1021/acs.orglett.7b03577

文献信息

• Aryl- and heteroaryl-substituted tetrahydroisoquinolines and use thereof to block reuptake of norepinephrine, dopamine, and serotonin
  申请人：Molino F. Bruce

  公开号：US20060052378A1

  公开（公告）日：2006-03-09

  The compounds of the present invention are represented by the chemical structure found in Formula (I): wherein: the carbon atom designated * is in the R or S configuration; and X is a fused bicyclic carbocycle or heterocycle selected from the group consisting of benzofuranyl, benzo[b]thiophenyl, benzoisothiazolyl, benzoisoxazolyl, indazolyl, indolyl, isoindolyl, indolizinyl, benzoimidazolyl, benzooxazolyl, benzothiazolyl, benzotriazolyl, imidazo[1,2-a]pyridinyl, pyrazolo[1,5-a]pyridinyl, [1,2,4]triazolo[4,3-a]pyridinyl, thieno[2,3-b]pyridinyl, thieno[3,2-b]pyridinyl, 1H-pyrrolo[2,3-b]pyridinyl, indenyl, indanyl, dihydrobenzocycloheptenyl, tetrahydrobenzocycloheptenyl, dihydrobenzothiophenyl, dihydrobenzofuranyl, indolinyl, naphthyl, tetrahydronaphthyl, quinolinyl, isoquinolinyl, 4H-quinolizinyl, 9aH-quinolizinyl, quinazolinyl, cinnolinyl, phthalazinyl, quinoxalinyl, benzo[1,2,3]triazinyl, benzo[1,2,4]triazinyl, 2H-chromenyl, 4H-chromenyl, and a fused bicyclic carbocycle or fused bicyclic heterocycle optionally substituted with substituents (1 to 4 in number) as defined in R 14 ; with R 1 , R 2 , R 3 , R 4 , R 5 , R 6 , R 7 , R 8 , and R 14 defined herein.

  本发明的化合物由以下式中的化学结构表示（I）： 其中： 指定为*的碳原子处于R或S构型；X是从苯并呋喃基、苯并噻吩基、苯并异噻唑基、苯并异噁唑基、吲哚基、吲哚基、异吲哚基、吲哚啉基、苯并咪唑基、苯并噁唑基、苯并噻唑基、苯并三唑基、咪唑并[1,2-a]吡啶基、吡唑并[1,5-a]吡啶基、[1,2,4]三唑并[4,3-a]吡啶基、噻吩并[2,3-b]吡啶基、噻吩并[3,2-b]吡啶基、1H-吡咯并[2,3-b]吡啶基、茚基、茚基、二氢苯并环庚烯基、四氢苯并环庚烯基、二氢苯并噻吩基、二氢苯并呋喃基、吲啉基、萘基、四氢萘基、喹啉基、异喹啉基、4H-喹啉基、9aH-喹啉基、喹唑啉基、喜啉基、邻苯二嗪基、喹啉基、苯并[1,2,3]三嗪基、苯并[1,2,4]三嗪基、2H-香豆素基、4H-香豆素基或者是一个可选地用取代基（1至4个）取代的螺联苯环或螺联杂环的螺联双环碳环或螺联双环杂环； 其中R1、R2、R3、R4、R5、R6、R7、R8和R14在此处定义。
• Mapping Ambiphile Reactivity Trends in the <i>Anti</i> ‐(Hetero)annulation of Non‐Conjugated Alkenes via Pd ^II /Pd ^IV Catalysis
  作者：Hui‐Qi Ni、Phillippa Cooper、Shouliang Yang、Fen Wang、Neal Sach、Pranali G. Bedekar、Joyann S. Donaldson、Michelle Tran‐Dubé、Indrawan J. McAlpine、Keary M. Engle

  DOI：10.1002/anie.202114346

  日期：2022.3.21

  from non-conjugated alkenyl amides and ambiphilic organohalides is described. Under PdII/PdIV catalysis, this [n+2] annulation proceeds in an anti-selective fashion and tolerates a wide array of ambiphiles, which are systematically benchmarked with respect to nucleophile identity, electrophile identity, and product ring-size. Otherwise unreactive ambiphilic ortho-haloacetophenones can be activated

  描述了从非共轭烯基酰胺和两亲性有机卤化物获得 5、6 和 7 元碳环和杂环的方法。在 Pd II /Pd IV催化下，这种 [ n +2] 环化以反选择性方式进行，并耐受多种双亲剂，这些双亲剂在亲核体特性、亲电子体特性和产物环大小方面进行了系统的基准测试。另外，非反应性两亲性邻卤代苯乙酮可以使用胺助催化剂来活化。
• Use of aryl- and heteroaryl-substituted tetrahydroisoquinolines to block reuptake of norepinephrine, dopamine, and serotonin
  申请人：Molino F. Bruce

  公开号：US20060063766A1

  公开（公告）日：2006-03-23

  The compounds of the present invention are represented by the chemical structure found in Formula (I): wherein: the carbon atom designated * is in the R or S configuration; and X is a fused bicyclic carbocycle or heterocycle selected from the group consisting of benzofuranyl, benzo[b]thiophenyl, benzoisothiazolyl, benzoisoxazolyl, indazolyl, indolyl, isoindolyl, indolizinyl, benzoimidazolyl, benzooxazolyl, benzothiazolyl, benzotriazolyl, imidazo[1,2-a]pyridinyl, pyrazolo[1,5-a]pyridinyl, [1,2,4]triazolo[4,3-a]pyridinyl, thieno[2,3-b]pyridinyl, thieno[3,2-b]pyridinyl, 1H-pyrrolo[2,3-b]pyridinyl, indenyl, indanyl, dihydrobenzocycloheptenyl, tetrahydrobenzocycloheptenyl, dihydrobenzothiophenyl, dihydrobenzofuranyl, indolinyl, naphthyl, tetrahydronaphthyl, quinolinyl, isoquinolinyl, 4H-quinolizinyl, 9aH-quinolizinyl, quinazolinyl, cinnolinyl, phthalazinyl, quinoxalinyl, benzo[1,2,3]triazinyl, benzo[1,2,4]triazinyl, 2H-chromenyl, 4H-chromenyl, and a fused bicyclic carbocycle or fused bicyclic heterocycle optionally substituted with substituents (1 to 4 in number) as defined in R 14 ; with R 1 , R 2 , R 3 , R 4 , R 5 , R 6 , R 7 , R 8 , and R 14 defined herein.

  本发明的化合物由公式（I）中的化学结构表示：其中：指定*的碳原子处于R或S构型中；X是从苯并呋喃基、苯并[b]噻吩基、苯并异噻唑基、苯并异噁唑基、吲哚基、吲哚基、异吲哚基、吲哚咪唑基、苯并噁唑基、苯并噻唑基、苯并三氮唑基、咪唑并[1,2-a]吡啶基、吡唑并[1,5-a]吡啶基、[1,2,4]三唑并[4,3-a]吡啶基、噻吩并[2,3-b]吡啶基、噻吩并[3,2-b]吡啶基、1H-吡咯并[2,3-b]吡啶基、茚基、茚基、二氢苯并环庚基、四氢苯并环庚基、二氢苯并噻吩基、二氢苯并呋喃基、吲哚啉基、萘基、四氢萘基、喹啉基、异喹啉基、4H-喹啉啶基、9aH-喹啉啶基、喹唑啉基、茜素啉基、邻苯二酚基、喹啉并[1,2,3]三唑基、喹啉并[1,2,4]三唑基、2H-香豆素基、4H-香豆素基或者是一个融合的双环碳环或融合的双环杂环，可选地用R14中定义的取代基（1至4个）取代；其中R1、R2、R3、R4、R5、R6、R7、R8和R14在此定义。
• ARYL- AND HETEROARYL-SUBSTITUTED TETRAHYDROISOQUINOLINES AND USE THEREOF TO BLOCK REUPTAKE OF NOREPINEPHRINE, DOPAMINE, AND SEROTONIN
  申请人：MOLINO Bruce F.

  公开号：US20090253906A1

  公开（公告）日：2009-10-08

  The compounds of the present invention are represented by the chemical structure found in Formula (I): wherein: the carbon atom designated * is in the R or S configuration; and X is a fused bicyclic carbocycle or heterocycle selected from the group consisting of benzofuranyl, benzo[b]thiophenyl, benzoisothiazolyl, benzoisoxazolyl, indazolyl, indolyl, isoindolyl, indolizinyl, benzoimidazolyl, benzooxazolyl, benzothiazolyl, benzotriazolyl, imidazo[1,2-a]pyridinyl, pyrazolo[1,5-a]pyridinyl, [1,2,4]triazolo[4,3 -a]pyridinyl, thieno[2,3-b]pyridinyl, thieno[3,2-b]pyridinyl, 1H-pyrrolo[2,3-b]pyridinyl, indenyl, indanyl, dihydrobenzocycloheptenyl, tetrahydrobenzocycloheptenyl, dihydrobenzothiophenyl, dihydrobenzofuranyl, indolinyl, naphthyl, tetrahydronaphthyl, quinolinyl, isoquinolinyl, 4H-quinolizinyl, 9aH-quinolizinyl, quinazolinyl, cinnolinyl, phthalazinyl, quinoxalinyl, benzo[1,2,3]triazinyl, benzo[1,2,4]triazinyl, 2H-chromenyl, 4H-chromenyl, and a fused bicyclic carbocycle or fused bicyclic heterocycle optionally substituted with substituents (1 to 4 in number) as defined in R 14 ; with R 1 , R 2 , R 3 , R 4 , R 5 , R 6 , R 7 , R 8 , and R 14 defined herein.

  本发明的化合物由公式（I）中的化学结构表示：其中：指定的碳原子*处于R或S构型；并且X是从苯并呋喃基，苯并[b]噻吩基，苯并异噻唑基，苯并异恶唑基，吲哚基，吲哚基，异吲哚基，吲哚吩基，苯并咪唑基，苯并噁唑基，苯并噻唑基，苯并三唑基，咪唑[1,2-a]吡啶基，吡唑并[1,5-a]吡啶基，[1,2,4]三唑并[4,3-a]吡啶基，噻吩并[2,3-b]吡啶基，噻吩并[3,2-b]吡啶基，1H-吡咯并[2,3-b]吡啶基，茚基，茚基，二氢苯并环庚烯基，四氢苯并环庚烯基，二氢苯并噻吩基，二氢苯并呋喃基，吲哚啉基，萘基，四氢萘基，喹啉基，异喹啉基，4H-喹唑啉基，9aH-喹唑啉基，喹嗪基，茚并吡啶基，邻苯二酚基，喹啉并苯并三唑基，2H-香豆素基，4H-香豆素基或者是一个融合的双环碳环或融合的双环杂环，可选地用定义在R14中的取代基（1到4个）取代；其中R1，R2，R3，R4，R5，R6，R7，R8和R14在此定义。
• ARYL-AND HETEROARYL-SUBSTITUTED TETRAHYDROISOQUINOLINES AND USE THEREOF TO BLOCK REUPTAKE OF NOREPINEPHRINE, DOPAMINE, AND SEROTONIN
  申请人：AMR Technology, Inc.

  公开号：EP1778639A2

  公开（公告）日：2007-05-02