2-Phenyl-3-methyl-6-methoxy-carbonyl-3,6-dihydro-1,2-oxazin | 91957-89-0

• 分子结构分类: 有机化合物 - 苯类化合物 - N-苯基羟胺
• 英文名称: 2-Phenyl-3-methyl-6-methoxy-carbonyl-3,6-dihydro-1,2-oxazin
• 英文别名: Methyl 3-methyl-2-phenyl-3,6-dihydrooxazine-6-carboxylate
• CAS: 91957-89-0
• 化学式: C₁₃H₁₅NO₃
• 分子量: 233.267
• InChiKey: XVYVKLAMFZAANS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  38.8
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  山梨酸甲酯 、 亚硝基苯 以 二氯甲烷 为溶剂， 生成 2-Phenyl-3-methyl-6-methoxy-carbonyl-3,6-dihydro-1,2-oxazin
  参考文献：
  名称：

  亚硝酰基-IX的加成反应：Die Diels-Alder-reaktion von 1-mono-BZW。1,4-二取代二烯

  摘要：

  已经通过几种方法确定了用亚硝基化合物在1-烯和1，4-二取代二烯的二烯合成中的取向。详细描述了这些方法和加合物的性质。

  DOI：

  10.1016/0040-4020(68)88054-8

文献信息

• Kresze,G.; Firl,J., Angewandte Chemie, 1964, vol. 76, p. 439
  作者：Kresze,G.、Firl,J.

  DOI：——

  日期：——
• [EN] OXAZA HETEROCYCLIC COMPOUNDS FOR PHOTOTHERAPY<br/>[FR] COMPOSÉS OXAZA HÉTÉROCYCLIQUES POUR PHOTOTHÉRAPIE
  申请人：MALLINCKRODT INC

  公开号：WO2010132547A2

  公开（公告）日：2010-11-18

  The invention relates generally to optical agents, including phototherapeutic agents, for biomedical applications, including phototherapy. The invention includes optical agents, and related therapeutic methods, comprising oxaza compounds, including 1,2 oxaza heterocyclic compounds, having a photolabile N-O bond directly or indirectly linked to at least one carbocyclic aromatic and/or heterocyclic aromatic group. In some embodiments, for example, the invention provides oxaza compounds, such as oxazolines and isoxazolidines, for phototherapeutic methods having a photolabile N-O bond that undergoes photoactivated cleavage to produce reactive species, such as radicals, ions, etc., that achieve a desired therapeutic effect, such as selective and/or localized tissue damage and/or cell death.
• Additionsreaktionen der nitrosogruppe—IX
  作者：G. Kresze、J. Firl

  DOI：10.1016/0040-4020(68)88054-8

  日期：1968.1

  The orientation in the diene synthesis of 1- and 1,4-disubstituted dienes with nitroso compounds has been determined by several methods. These methods and the properties of the adducts are described in detail.

  已经通过几种方法确定了用亚硝基化合物在1-烯和1，4-二取代二烯的二烯合成中的取向。详细描述了这些方法和加合物的性质。