Bicyclo[3.2.1]octane-1-carbaldehyde | 26845-35-2

• 分子结构分类: 有机化合物 - 有机氧化合物 - 有机氧化物
• 英文名称: Bicyclo[3.2.1]octane-1-carbaldehyde
• CAS: 26845-35-2
• 化学式: C₉H₁₄O
• 分子量: 138.21
• InChiKey: HMCGOXDZKSJAIR-UHFFFAOYSA-N

物化性质

• 熔点：
  70.5-72.5 °C
• 沸点：
  196.8±9.0 °C(Predicted)
• 密度：
  1.112±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2
• 重原子数：
  10
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.89
• 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：

  Bicyclo[3.2.1]octane-1-carbaldehyde 、 三氟甲磺酸苄酯 、 三氟甲磺酸 、 四氯化碳 、 水 以64%的产率得到
  参考文献：
  名称：

  TAKEUCHI, KENICHI;IKAI, KEIZO;YOSHIDA, MASAYASU;TSUGENO, AKIO, TETRAHEDRON, 44,(1988) N 18, C. 5681-5694

  摘要：

  DOI：
• 作为产物：
  描述：

  二环[3.3.1]壬-1-烯 在 间氯过氧苯甲酸 作用下， 以 氯仿 为溶剂， 生成 Bicyclo[3.2.1]octane-1-carbaldehyde
  参考文献：
  名称：

  Bredt's rule. III. Synthesis and chemistry of bicyclo[3.3.1]non-1-ene

  摘要：

  DOI：

  10.1021/ja00707a035

文献信息

• [EN] NOVEL 2,7-DIOXO-BICYCLO[4.3.0]NON-5-YL-UREA DERIVATIVES<br/>[FR] NOUVEAUX DERIVES DE 2,7-DIOXO-BICYCLO[4.3.0]NON-5-YL-UREE
  申请人：SYNGENTA PARTICIPATIONS AG

  公开号：WO2005005432A1

  公开（公告）日：2005-01-20

  The present invention relates to novel fungicidal 2,7-dioxo-bicyclo[4.3.0] non-5-yl-urea derivatives, to processes for their preparation and to certain intermediate chemicals used in those processes. It also relates to the use of the compounds as biocides, to compositions containing biocidally effective amounts of the compounds and to methods of combating pathogens using the compounds. The invention encompasses 2,7-dioxo-bicyclo[4.3.0]non-5-yl-urea derivatives of formula (I) wherein R is H or C1-6alkyl (for example, methyl), the RO group is cis- or trans- to the NH2CONH group, R1 is H, formyl, C1-8alkylcarbonyl, C3-8cycloalkylcarbonyl, or optionally substituted benzoyl, and X is a N-linked heterocyclic group of the formula (II) or of the formula (III), wherein R2 is H, C1-4alkyl (especially methyl) or halo, or of the formula (IV): The compounds of formula I possess useful plant protecting properties and may advantageously be employed in agricultural practice for controlling or preventing the infestation of plants by phytopathogenic microorganisms, especially fungi.

  本发明涉及新型杀真菌2,7-二氧代双环[4.3.0]戊-5-基脲衍生物，其制备方法以及在这些方法中使用的某些中间化学品。它还涉及将这些化合物用作生物杀菌剂，含有这些化合物生物杀菌有效量的组合物，以及使用这些化合物来对抗病原体的方法。本发明涵盖了公式（I）中R为H或C1-6烷基（例如，甲基），RO基团与NH2CONH基团的位置为顺式或反式，R1为H，甲酰基，C1-8烷基羰基，C3-8环烷基羰基，或者可选择取代的苯甲酰基，X为公式（II）或公式（III）的N-连接杂环基团，其中R2为H，C1-4烷基（尤其是甲基）或卤素，或者为公式（IV）的化合物：公式I的化合物具有有益的植物保护性能，并可有利地用于农业实践中，用于控制或预防植物受植物病原微生物，尤其是真菌的侵害。
• METHOD FOR PRODUCING KAKEROMYCIN AND DERIVATIVES THEREOF
  申请人：OP BIO FACTORY CO., LTD.

  公开号：US20180037555A1

  公开（公告）日：2018-02-08

  Provided is a production method of kakeromycin and a derivative thereof showing an antifungal activity and cytotoxicity and expected as a new antifungal agent or anticancer agent, by chemical synthesis. A production method of a compound represented by the formula (1): wherein R is an optionally substituted hydrocarbon group or an optionally substituted heterocyclic group; and n is 0 or 1, or a salt thereof, including a step of subjecting a compound represented by the formula (2): wherein R and n are as defined above, or a salt thereof, to an oxidation reaction.

  提供了一种生产kakeromycin及其衍生物的方法，该衍生物表现出抗真菌活性和细胞毒性，并被期望作为新的抗真菌剂或抗癌剂，通过化学合成。一种化合物的生产方法，该化合物由公式（1）表示：其中R是可选取代的烃基或可选取代的杂环基；n为0或1，或其盐，包括将由公式（2）表示的化合物进行氧化反应的步骤：其中R和n如上定义，或其盐。
• 2-OXOIMIDAZOLE DERIVATIVES
  申请人：BANYU PHARMACEUTICAL CO., LTD.

  公开号：EP0990653A1

  公开（公告）日：2000-04-05

  The present invention relates to a compound represented by Formula [I] [wherein represents an aromatic carbo- or heterocyclic ring which may have a substituent; Cy represents a mono-, bi- or tricyclic aliphatic carbocyclic group having 3 to 20 carbon atoms, which may have a substituent; represents a mono- or bicyclic aliphatic nitrogen-containing heterocyclic group having 3 to 14 carbon atoms, which may have a substituent; R1 represents a hydrogen atom, a lower alkenyl group, a lower alkynyl group, a cyclo(lower alkyl) group, an amino group, a lower alkylamino group, a di(lower alkyl)amino group, a hydroxyl group, a lower alkoxy group, a carboxyl group, a lower alkoxycarbonyl group, a carbamoyl group, a lower alkylcarbamoyl group or a di(lower alkyl)carbamoyl group, or a lower alkyl group which may have a substituent; and R 2 represents a hydrogen atom or a lower alkyl group], a salt or ester thereof, a production process for the same, and an analgesic, a reliever against tolerance to a narcotic analgesic represented by morphine, a reliever against dependence on a narcotic analgesic represented by morphine, an analgesic enhancer, an antiobestic, a drug for ameliorating brain function, a remedy for schizophrenia, a remedy for Parkinsonism, a remedy for chorea, an antidepressant, a remedy for diabetes insipidus, a remedy for polyuria, or a remedy for hypotension, comprising an effective ingredient of the same.

  本发明涉及一种由式[I]表示的化合物 其中 代表芳香族碳环或杂环，可以有取代基； Cy 代表具有 3 至 20 个碳原子的单环、双环或三环脂族碳环基团，可以有取代基； 代表具有 3 至 14 个碳原子的单环或双环脂族含氮杂环基团，该基团可具有取代基；R1 代表氢原子、低级烯基、低级炔基、环(低级烷基)基团、氨基、低级烷基氨基、二(低级烷基)氨基、羟基、低级烷氧基、羧基、低级烷氧羰基、氨基甲酰基、低级烷基氨基甲酰基或二(低级烷基)氨基甲酰基，或可带有取代基的低级烷基；以及 R 2 代表氢原子或低级烷基]，其盐或酯，其生产工艺，以及一种镇痛剂、一种防止对以吗啡为代表的麻醉性镇痛剂产生耐受性的缓解剂、一种防止对以吗啡为代表的麻醉性镇痛剂产生依赖性的缓解剂、一种镇痛增强剂、一种抗抑郁剂、一种改善脑功能的药物、一种治疗精神分裂症的药物、一种治疗帕金森病的药物、一种治疗舞蹈症的药物、一种抗抑郁剂、一种治疗糖尿病的药物、一种治疗多尿症的药物或一种治疗低血压的药物，其中包括一种有效成分。
• Method for producing kakeromycin and derivatives thereof
  申请人：OP BIO FACTORY CO., LTD.

  公开号：US10106509B2

  公开（公告）日：2018-10-23

  Provided is a production method of kakeromycin and a derivative thereof showing an antifungal activity and cytotoxicity and expected as a new antifungal agent or anticancer agent, by chemical synthesis. A production method of a compound represented by the formula (1): wherein R is an optionally substituted hydrocarbon group or an optionally substituted heterocyclic group; and n is 0 or 1, or a salt thereof, including a step of subjecting a compound represented by the formula (2): wherein R and n are as defined above, or a salt thereof, to an oxidation reaction.

  本发明提供了一种通过化学合成生产具有抗真菌活性和细胞毒性并有望成为新型抗真菌剂或抗癌剂的卡克霉素及其衍生物的方法。一种由式（1）代表的化合物的生产方法： 其中 R 是任选取代的烃基或任选取代的杂环基；且 n 是 0 或 1，或其盐，包括使式（2）所代表的化合物受试的步骤： 其中 R 和 n 如上文所定义，或其盐，进行氧化反应。
• TAKEUCHI, KENICHI;IKAI, KEIZO;YOSHIDA, MASAYASU;TSUGENO, AKIO, TETRAHEDRON, 44,(1988) N 18, C. 5681-5694
  作者：TAKEUCHI, KENICHI、IKAI, KEIZO、YOSHIDA, MASAYASU、TSUGENO, AKIO

  DOI：——

  日期：——