2-(甲氧基甲基)苯甲醛 | 106020-70-6

• 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-(甲氧基甲基)苯甲醛
• 英文名称: 2-[(methoxymethyl)methyl]benzaldehyde
• 英文别名: 2-(methoxymethyl)-benzaldehyde；2-(methoxymethyl)benzaldehyde；o-(methoxymethyl)benzaldehyde；2-methoxymethyl benzaldehyde；2-methoxymethylbenzaldehyde
• CAS: 106020-70-6
• 化学式: C₉H₁₀O₂
• 分子量: 150.177
• InChiKey: GPWBSZYCZARIHN-UHFFFAOYSA-N

物化性质

• 沸点：
  222.6±15.0 °C(Predicted)
• 密度：
  1.070±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.4
• 重原子数：
  11
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-(甲氧基甲基)苯甲醛 在 sodium ethanolate 作用下， 以 乙醇 为溶剂， 反应 10.0h， 生成 1-methoxybenzocyclobutene
  参考文献：
  名称：

  Intramolecular generation of oxonium ylides from functionalized arylcarbenes

  摘要：

  DOI：

  10.1021/ja00186a048
• 作为产物：
  描述：

  邻苯二甲醇 在 manganese(IV) oxide 、 sodium hydride 作用下， 以 四氢呋喃 、 氯仿 为溶剂， 生成 2-(甲氧基甲基)苯甲醛
  参考文献：
  名称：

  Anellated Hemicyanine Dyes with Large Symmetrical Solvatochromism of Absorption and Fluorescence

  摘要：

  A novel class of amphiphilic hemicyanine dyes is described where electron-pushing aniline and electron-pulling pyridinium are joined by anellated benzene rings. Enhancing the solvent polarity, the absorption band of these ANNINE dyes is shifted to the blue and the fluorescence band is shifted to the red at an invariant 00 energy. The increasing Stokes shift spans the whole visible spectrum. The divergent symmetrical solvatochromism of the positively charged chromophores is parametrized by a monopole-dipole model using a Born-Onsager-Marcus approach. From the intramolecular charge shift that is induced by electronic excitation, the linear Stark effect that is expected when the ANNINE dyes are used as voltage-sensitive probes in a biomembrane is estimated.

  DOI：

  10.1021/jp0345809

文献信息

• Wittig olefination: An efficient route for the preparation of allyl vinyl ethers - precursors for the Claisen rearrangement
  作者：Mukund G. Kulkarni、Dhananjay S. Pendharkar、Ravindra M. Rasne

  DOI：10.1016/s0040-4039(97)00057-9

  日期：1997.2

  A convenient procedure has been described for the preparation of allyl vinyl ethers-the precursors for the Claisen rearrangement

  已经描述了用于制备烯丙基乙烯基醚-克莱森重排的前体的方便程序。
• [EN] OXIMYL MACROCYCLIC DERIVATIVES<br/>[FR] DÉRIVÉS MACROCYCLIQUES D'OXIMYLE
  申请人：ENANTA PHARM INC

  公开号：WO2009073713A1

  公开（公告）日：2009-06-11

  The present invention relates to compounds of Formula I, or pharmaceutically acceptable salts, esters, or prodrugs thereof: ( i ) which inhibit serine protease activity, particularly the activity of hepatitis C virus (HCV) NS3-NS4A protease. Consequently, the compounds of the present invention interfere with the life cycle of the hepatitis C virus and are also useful as antiviral agents. The present invention further relates to pharmaceutical compositions comprising the aforementioned compounds for administration to a subject suffering from HCV infection. The invention also relates to methods of treating an HCV infection in a subject by administering a pharmaceutical composition comprising a compound of the present invention.

  本发明涉及式I化合物，或其药用可接受的盐、酯或前药：(i)抑制丝氨酸蛋白酶活性，尤其是丙型肝炎病毒(HCV) NS3-NS4A蛋白酶的活性。因此，本发明的化合物干扰丙型肝炎病毒的生命周期，并且还可用作抗病毒剂。本发明进一步涉及包含前述化合物的药物组合物，用于给患有HCV感染的对象服用。本发明还涉及通过管理包含本发明化合物的药物组合物来治疗主体HCV感染的方法。
• Hetero-Diels–Alder reaction of photochemically generated α-hydroxy-o-quinodimethanes with trifluoromethyl ketones
  作者：Ken Takaki、Toshifumi Fujii、Hosei Yonemitsu、Makoto Fujiwara、Kimihiro Komeyama、Hiroto Yoshida

  DOI：10.1016/j.tetlet.2012.05.082

  日期：2012.8

  Hetero-Diels–Alder reaction of α-hydroxy-o-quinodimethanes photochemically generated from o-tolualdehydes with trifluoromethyl ketones gave a mixture of hemiacetals and hydroxyaldehydes in fairly good yields. Their subsequent oxidation with PCC provided 1-isochromanones as formal oxidative [4+2] cycloaddition products. In contrast, similar reaction of aromatic ketones such as o-methylbenzophenone,

  由邻甲苯甲醛与三氟甲基酮光化学合成的α-羟基邻邻喹啉甲烷的Hetero -Diels-Alder反应得到了相当好的收率的半缩醛和羟基醛的混合物。随后用PCC氧化可提供1-异色酮类化合物，为正式的氧化性[4 + 2]环加成产物。相反，芳族酮如邻甲基二苯甲酮，1-茚满酮和α-四氢萘酮的类似反应仅得到在邻位具有（三氟甲基）羟甲基的相应酮。
• ACC INHIBITORS AND USES THEREOF
  申请人：Nimbus Apollo, Inc.

  公开号：US20130123231A1

  公开（公告）日：2013-05-16

  The present invention provides compounds useful as inhibitors of Acetyl CoA Carboxylase (ACC), compositions thereof, and methods of using the same.

  本发明提供了作为乙酰辅酶A羧化酶（ACC）抑制剂的化合物，以及其组合物和使用方法。
• Photochemical Synthesis, Conformational Analysis, and Transformation of [60]Fullerene−<i>o</i>-quinodimethane Adducts Bearing a Hydroxy Group
  作者：Yosuke Nakamura、Kyoji O-kawa、Satoshi Minami、Toshio Ogawa、Seiji Tobita、Jun Nishimura

  DOI：10.1021/jo0161328

  日期：2002.2.1

  photochemical reactions of [60]fullerene with various aromatic aldehydes or ketones 1a-n carrying an alkyl group at the ortho position were examined. Some of them afforded stable o-quinodimethane adducts 2 with a hydroxy group attached to the cyclohexene ring. The adducts 2 were found to adopt one or both of two conformers A and E, which possess pseudoaxial and pseudoequatorial hydroxy groups, respectively. The

  研究了[60]富勒烯与在邻位带有烷基的各种芳族醛或酮1a-n的光化学反应。他们中的一些提供了带有连接在环己烯环上的羟基的稳定的邻喹二甲烷加合物2。发现加合物2采用两个构象剂A和E之一或两者，它们分别具有伪轴和伪赤道羟基。构象比明显取决于与芳族核和环己烯环相连的取代基。还通过VT-NMR技术研究了2的动力学行为。