Cyclohexa-1,5-diene-1-carbonyl chloride | 784213-45-2

• 分子结构分类: 有机化合物 - 有机卤素化合物 - 酰卤
• 英文名称: Cyclohexa-1,5-diene-1-carbonyl chloride
• CAS: 784213-45-2
• 化学式: C₇H₇ClO
• 分子量: 142.585
• InChiKey: CPVYBKZJJYZOFD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.4
• 重原子数：
  9
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  Cyclohexa-1,5-diene-1-carbonyl chloride 在 吡啶 、 tetrapropylammonium periodate 作用下， 以 四氢呋喃 、 二氯甲烷 、 均三甲苯 为溶剂， 反应 50.0h， 生成 (1R,2S,7S,8S)-10-Benzoyl-9-oxa-10-aza-tricyclo[6.2.2.02,7]dodec-4-ene-7-carboxylic acid methyl ester
  参考文献：
  名称：

  Regioselectivity of the intermolecular Diels-Alder reaction of acyl nitroso compounds (C-nitrosocarbonyl compounds) and nitrosoformates (O-nitrosocarbonyl compounds). Preparation of functionalized cis-.DELTA.6-1-octalones

  摘要：

  DOI：

  10.1021/jo00211a025
• 作为产物：
  描述：

  3,4-dihydrobenzoic acid 在 草酰氯 、 N,N-二甲基甲酰胺 作用下， 以 四氢呋喃 为溶剂， 反应 18.0h， 生成 Cyclohexa-1,5-diene-1-carbonyl chloride
  参考文献：
  名称：

  Regioselectivity of the intermolecular Diels-Alder reaction of acyl nitroso compounds (C-nitrosocarbonyl compounds) and nitrosoformates (O-nitrosocarbonyl compounds). Preparation of functionalized cis-.DELTA.6-1-octalones

  摘要：

  DOI：

  10.1021/jo00211a025

文献信息

• [EN] 18 F - LABELLED 6 - ( 2 - FLUOROETHOXY) - 2 - NAPHTHALDEHYDE FOR DETECTING CANCER STEM CELLS<br/>[FR] 6-(2-FLUROÉTHOXY)-2-NAPHTALDÉHYDE MARQUÉ AU 18F POUR DÉTECTER DES CELLULES SOUCHES CANCÉREUSES
  申请人：GE HEALTHCARE LTD

  公开号：WO2013048832A1

  公开（公告）日：2013-04-04

  The present invention relates to in vivo imaging and radiotherapeutic methods and agents which target the enzyme aldehyde dehydrogenase (ALDH) and that are suitable for the in vivo imaging of tumours and treatment of cancer.

  本发明涉及针对醛脱氢酶(ALDH)的体内成像和放射治疗方法及试剂，适用于肿瘤的体内成像和癌症治疗。
• [EN] IMAGING AND RADIOTHERAPY METHODS FOR TUMOUR STEM CELLS<br/>[FR] PROCÉDÉS D'IMAGERIE ET DE RADIOTHÉRAPIE POUR LES CELLULES SOUCHES TUMORALES
  申请人：GE HEALTHCARE LTD

  公开号：WO2013048811A1

  公开（公告）日：2013-04-04

  The present invention relates to in vivo imaging and radiotherapeutic methods and agents which target the enzyme aldehyde dehydrogenase (ALDH) and that are suitable for the in vivo imaging of tumours and treatment of cancer.

  本发明涉及体内成像和放射治疗方法以及靶向醛脱氢酶（ALDH）的药物，适用于肿瘤的体内成像和癌症治疗。
• THERAPEUTIC AMINE-ARYLSULFONAMIDE CONJUGATE COMPOUNDS
  申请人：MORGAN Philip F.

  公开号：US20100311727A1

  公开（公告）日：2010-12-09

  Therapeutic amine-arylsulfonamide conjugate compounds, of the general formula: wherein R′ is [D-W-], hydroxyl, or alkoxyl; R″ is independently [D-W′-], hydrogen, alkoxy, alkyl, cycloalkyl, alkenyl, alkynyl or aryl, or R″ and R″ together with the nitrogen atom to which they are attached form a 4-, 5-, 6-, 7- or 8-membered ring optionally containing one or two further heteroatoms independently selected from nitrogen, oxygen and sulfur; D is independently a therapeutic amine radical comprising at least one nitrogen atom and optionally at least one oxygen atom coupled to W or W′ by a nitrogen or oxygen atom; W and W′ are a chemical bond or linker; wherein either R′ is [D-W-] or at least one R″ is [D-W′-], and pharmaceutically acceptable esters, amides, salts or solvates thereof, pharmaceutical compositions containing same, methods for their preparation, and their use in treating psychiatric, neurologic and metabolic disorders are disclosed.

  治疗性胺基-芳基磺酰胺偶联化合物，一般式如下：其中，R′为[D-W-]、羟基或烷氧基；R″独立地为[D-W′-]、氢、烷氧基、烷基、环烷基、烯基、炔基或芳基，或R″和与它们连接的氮原子一起形成一个含有1或2个来自氮、氧和硫的进一步杂原子的4、5、6、7或8元环，D独立地为治疗性胺基基团，包括至少一个氮原子，通过氮或氧原子与W或W'耦合，W和W'为化学键或连接基，其中R′为[D-W-]或至少一个R″为[D-W′-]，以及其药学上可接受的酯、酰胺、盐或溶剂化物，包含它们的制备方法，以及它们用于治疗精神病、神经病和代谢疾病的用途。
• Heterocyclic compound and organic light emitting device using same
  申请人：LT MATERIALS CO., LTD.

  公开号：US10644244B2

  公开（公告）日：2020-05-05

  The present application provides a hetero-cyclic compound which may significantly improve the service life, efficiency, electrochemical stability, and thermal stability of an organic light emitting device, and an organic light emitting device in which the hetero-cyclic compound is contained in an organic compound layer.

  本申请提供了一种可显著提高有机发光器件的使用寿命、效率、电化学稳定性和热稳定性的杂环化合物，以及一种在有机化合物层中含有该杂环化合物的有机发光器件。
• Asymmetric synthesis of tetrahydropyran[3,2-c]quinolinones via an organocatalyzed formal [3 + 3] annulation of quinolinones and MBH 2-naphthoates of nitroolefin
  作者：Jian Li、Qi-Long Hu、Xue-Ping Chen、Ke-Qiang Hou、Albert S.C. Chan、Xiao-Feng Xiong

  DOI：10.1016/j.cclet.2019.08.040

  日期：2020.3

  An efficient asymmetric and enantio-swithchable organocatalytic [3 + 3] annulation reaction using MBH-2-naphthoates of nitroalkenes and 4-hydroxyquinolin-2(1H)-ones has been developed. Densely substituted tetrahydropyrano[3,2-c]quinolinones scaffolds with two adjacent stereogenic centers are obtained with high yield (up to 95% yield) and good stereoselectivities (up to >20:1 dr and 96% ee) in an enantio-switchable manner. Furthermore, gram scale synthesis was achieved and the nitro group could easily transform into an amino group without any appreciable loss in the diastereo- and enantioselectivity. (C) 2019 Chinese Chemical Society and Institute of Materia Medica, Chinese Academy of Medical Sciences. Published by Elsevier B.V. All rights reserved.