(E)-propionaldehyde oxime | 22042-15-5

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: (E)-propionaldehyde oxime
• 英文别名: propionaldehyde oxime；anti-propionaldoxime；propionaldoxime；propanal oxime；propionaldehyde (E)-oxime；(1E)-propanal oxime；(NE)-N-propylidenehydroxylamine
• CAS: 22042-15-5
• 化学式: C₃H₇NO
• 分子量: 73.0947
• InChiKey: IFDZZSXEPSSHNC-ONEGZZNKSA-N

物化性质

• 沸点：
  132.1±3.0 °C(Predicted)
• 密度：
  0.90±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.5
• 重原子数：
  5
• 可旋转键数：
  1
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  32.6
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  (E)-propionaldehyde oxime 在 N-氯代丁二酰亚胺 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 (Z)-N-hydroxypropionimidoyl chloride
  参考文献：
  名称：

  [EN] AMINO PYRIDINE DERIVATIVES AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS
  [FR] DÉRIVÉS AMINÉS DE PYRIDINE UTILISABLES EN TANT QU'INHIBITEURS DE LA PHOSPHATIDYLINOSITOL 3-KINASE

  摘要：

  本发明提供了公式(I)的化合物，这些化合物抑制PI 3-激酶γ异构体的活性，对于治疗由PI 3-激酶γ异构体激活介导的疾病是有用的。

  公开号：

  WO2015162456A1
• 作为产物：
  描述：

  anti-pyruvic aldehyde 1-oxime 以 乙醇 为溶剂， 以65%的产率得到(E)-propionaldehyde oxime
  参考文献：
  名称：

  HETEROCYCLIC COMPOUNDS AS PESTICIDES

  摘要：

  本申请涉及使用杂环化合物来控制动物害虫，包括节肢动物、昆虫和线虫，涉及新型杂环化合物，它们的制备方法以及制备杂环化合物的中间体。

  公开号：

  US20150239847A1
• 作为试剂：
  描述：

  2-[(1R)-1-[3,6-dimethyl-2-(2-methylindazol-5-yl)-4-oxochromen-8-yl]ethoxy]benzonitrile 在 (E)-propionaldehyde oxime 、 Wilkinson's catalyst 作用下， 以 甲苯 为溶剂， 以46 %的产率得到2-[(1R)-1-[3,6-dimethyl-2-(2-methylindazol-5-yl)-4-oxochromen-8-yl]ethoxy]benzamide
  参考文献：
  名称：

  WO2024097172A1

  摘要：

  公开号：

文献信息

• BISOXIMES AS FUNGICIDES
  申请人：Cerezo-Galvez Silvia

  公开号：US20100022559A1

  公开（公告）日：2010-01-28

  The invention relates to the novel use of bisoximes, some of which are known, for controlling unwanted microorganisms, and to processes for their preparation, and also to novel bisoximes, to processes for their preparation and to their use for controlling unwanted microorganisms and insects in crop protection and in the protection of materials.

  这项发明涉及对一些已知的双肟类化合物的新用途，用于控制不受欢迎的微生物，以及用于它们的制备方法，还涉及新的双肟类化合物，它们的制备方法以及它们在农作物保护和材料保护中用于控制不受欢迎的微生物和昆虫的用途。
• New geiparvarin analogues from 7-(2-oxoethoxy)coumarins as efficient in vitro antitumoral agents
  作者：Stefano Chimichi、Marco Boccalini、Barbara Cosimelli、Giampietro Viola、Daniela Vedaldi、Francesco Dall'Acqua

  DOI：10.1016/s0040-4039(02)01798-7

  日期：2002.10

  A new class of compounds analogues of geiparvarin is described: aldolic condensation of 3(2H)-furanones and 7-(2-oxoethoxy)coumarins followed by a very efficient dehydration protocol led to the title compounds which show good antitumoral activity against several human cell lines.

  描述了一种新的盖帕瓦林类似物的化合物类似物：3（2 H）-呋喃酮和7-（2-氧代乙氧基）香豆素的醛缩合反应，然后通过非常有效的脱水步骤，可得到标题化合物，该化合物显示出对几种人的良好抗肿瘤活性细胞系。
• 1,2,4-oxadiazolyl-phenoxyalkylisoxazoles and their use as antiviral
  申请人：Sterling Drug Inc.

  公开号：US05175178A1

  公开（公告）日：1992-12-29

  Compounds of the formulas ##STR1## wherein: Y is an alkylene bridge of 3-9 carbon atoms; R' is lower-alkyl or hydroxy-lower-alkyl of 1-5 carbon atoms; R.sub.1 and R.sub.2 are hydrogen, halogen, lower-alkyl, lower-alkoxy, nitro, lower-alkoxycarbonyl or trifluoromethyl; and R.sub.8 is hydrogen or lower-alkyl of 1-5 carbon atoms, with the proviso that when R.sub.8 is hydrogen R' is hydroxy-lower-alkyl, are useful as antiviral agents, particularly against picornaviruses, including numerous strains of rhinovirus.

  化学式为##STR1##的化合物，其中：Y是3-9个碳原子的烷基桥；R'为1-5个碳原子的低碳基或羟基低碳基；R.sub.1和R.sub.2为氢、卤素、低碳基、低碳氧基、硝基、低碳氧羰基或三氟甲基；R.sub.8为氢或1-5个碳原子的低碳基，但当R.sub.8为氢时，R'为羟基低碳基。这些化合物可用作抗病毒剂，特别是对抗多种鼻病毒菌株，包括脊髓灰质炎病毒。
• New 5-(2-ethenylsubstituted)-3(2H)-furanones with in vitro antiproliferative activity
  作者：Stefano Chimichi、Marco Boccalini、Barbara Cosimelli、Francesco Dall'Acqua、Giampietro Viola

  DOI：10.1016/s0040-4020(03)00776-2

  日期：2003.7

  A convenient route to new 3(2H)-furanones is described through hydrogenolysis and subsequent acidic hydrolysis of isoxazoles. The antiproliferative activity of title compounds were evaluated against leukemia-, carcinoma-, neuroblastoma-, and sarcoma-derived human cell lines in comparison to the natural compound geiparvarin. The structure activity relationship indicated that the maximum in vitro antiproliferative activity correlates with the presence of a heterocyclic ring on the ethenyl moiety. (C) 2003 Elsevier Science Ltd. All rights reserved.
• The [(Methyloxy)imino]methyl Moiety as a Bioisoster of Aryl. A Novel Class of Completely Aliphatic .beta.-Adrenergic Receptor Antagonists
  作者：Bruno Macchia、Aldo Balsamo、M. C. Breschi、Grazia Chiellini、Marco Macchia、Adriano Martinelli、Claudia Martini、Claudia Nardini、Susanna Nencetti

  DOI：10.1021/jm00036a018

  日期：1994.5

  Previous studies in the field of beta-adrenergic drugs had supported the hypothesis of the existence of a bioisosterism between the [(methyleneamino)oxy]methyl moiety (C=NOCH2, MAOMM) of type B beta-blocking drugs and the aryl (Ar) of type A beta-blocking agents. In the MAOMM, however, the carbon of the CH2 linked to the oximic oxygen possesses a hybridization (sp(3)) and a geometry different from those of the corresponding carbon of Ar which possesses an sp(2) hybridization. Furthermore, in the MAOMM, in its preferred conformation, the unsaturated portion (C=N) is situated in a spatial area which does not correspond exactly to the area occupied by Ar. The formal inversion of the atomic sequence C=NOCH2 of the MAOMM leads to a different type of group, the [(methyloxy)imino] methyl moiety (CH2ON=C, MOIMM), which, in the E configuration, appears to present greater steric and electronic analogies with an Ar, with respect to the MAOMM. On the basis of these observations, some completely aliphatic (E)-N-(3-amino-2-hydroxypropylidene) (alkyloxy)amino derivatives of type C (11a,b and 12a,b) were synthesized, the their beta-adrenergic properties were compared with those of the corresponding [(methyleneamino)oxy]methyl isomers of type B (19a,b and 20a,b). The similar beta-adrenergic properties of 11,12 and 19,20 evaluated in vitro both by radioligand binding assays and by functional tests on isolated preparations, are discussed on the basis of considerations regarding the spatial correspondences and electronic analogies between the MOIMM and the MAOMM.

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