1-phenyl-3-[2-(4-oxo-4H-benzo[d][1,3]oxazin-2-yl)-pheny]-urea | 880337-04-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并恶嗪类
• 英文名称: 1-phenyl-3-[2-(4-oxo-4H-benzo[d][1,3]oxazin-2-yl)-pheny]-urea
• 英文别名: N-[2-(4-Oxo-4H-3,1-benzoxazin-2-yl)phenyl]-N'-phenylurea；1-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]-3-phenylurea
• CAS: 880337-04-2
• 化学式: C₂₁H₁₅N₃O₃
• 分子量: 357.368
• InChiKey: DXIUKYIPJNVLJM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  27
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  79.8
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  2-(2-氨基苯基)-3,1-苯并恶嗪-4-酮 、 异氰酸苯酯 以 丁酮 为溶剂， 反应 0.5h， 生成 1-phenyl-3-[2-(4-oxo-4H-benzo[d][1,3]oxazin-2-yl)-pheny]-urea
  参考文献：
  名称：

  [EN] ARYL-UREIDO BENZOXAZINONE COMPOUNDS
  [FR] COMPOSES D'ARYL UREIDO BENZOXAZINONE

  摘要：

  含有芳基脲基苯并噁嗪酮化合物的荧光颜料化合物，其一般式为（I）：其中R1是取代或未取代的芳基，R2和R3各自独立地选自氢原子、烷基、烷氧基、烷基羧基和卤素原子，X是碳或硫原子，n是大于或等于I的整数。这类化合物中的许多产生黄色，通常是深黄色，在适当的紫外光源激发下发射波长约为560至585纳米。这些化合物产生荧光，使它们在荧光颜料中有用，其中那些在被紫外光源激发时提供从约560至585或更高范围内的发射波长的化合物特别有用。这些化合物的发射光谱使它们在安全应用中特别有用，特别是作为安全油墨和纤维用颜料。

  公开号：

  WO2006036790A1

文献信息

• Aryl-ureido benzoxazinone compounds
  申请人：Potrawa Thomas

  公开号：US20060065154A1

  公开（公告）日：2006-03-30

  Fluorescent pigment compounds comprising aryl-ureido benzoxazinone compounds of the general formula (I): wherein R 1 is an substituted or unsubstituted aryl group, R 2 and R 3 are each independently selected from an H atom, an alkyl group, an alkoxy group, an alkylcarboxy group and a halogen atom, X is a carbon or sulfur atom and n is an integer of 1 or more. Many of the compounds of this class produce a yellow, generally deep yellow, emission at wavelengths of about 560 to about 585 nm when excited by an appropriate UV source. These compounds produce fluorescence making them useful as fluorescent pigments, those compounds providing emission wavelengths within the range of from about 560 to about 585 or higher when excited by a UV source are particularly useful. Those compounds having this emission spectra for the compounds makes these compounds particularly useful as pigments in security applications, particularly as pigments for use in security inks and fibers.

  含有芳基脲基苯并噁唑酮化合物的荧光颜料化合物，其通式为(I)：其中，R1是取代或未取代的芳基基团，R2和R3各自独立地选择自氢原子、烷基、烷氧基、烷基羧基和卤素原子，X是碳或硫原子，n是1或更多的整数。这类化合物中的许多化合物在受到适当的紫外线源激发时产生黄色，通常是深黄色的发射，在约560至约585纳米的波长范围内产生荧光，使它们有用作荧光颜料。当受到紫外线源激发时，这些化合物提供从约560至约585或更高的发射波长，使它们特别有用作安全应用中的颜料，特别是作为安全油墨和纤维中的颜料。
• ARYL-UREIDO BENZOXAZINONE COMPOUNDS
  申请人：Honeywell International, Inc.

  公开号：EP1794136A1

  公开（公告）日：2007-06-13
• US7192471B2
  申请人：——

  公开号：US7192471B2

  公开（公告）日：2007-03-20
• [EN] ARYL-UREIDO BENZOXAZINONE COMPOUNDS<br/>[FR] COMPOSES D'ARYL UREIDO BENZOXAZINONE
  申请人：HONEYWELL INT INC

  公开号：WO2006036790A1

  公开（公告）日：2006-04-06

  Fluorescent pigment compounds comprising aryl-ureido benzoxazinone compounds of the general formula (I): wherein R1 is an substituted or unsubstituted aryl group, R2 and R3 are each independently selected from an H atom, an alkyl group, an alkoxy group, an alkylcarboxy group and a halogen atom, X is a carbon or sulfur atom and n is an integer of I or more. Many of the compounds of this class produce a yellow, generally deep yellow, emission at wavelengths of about 560 to about 585 nm when excited by an appropriate UV source. These compounds produce fluorescence making them useful as fluorescent pigments, those compounds providing emission wavelengths within the range of from about 560 to about 585 or higher when excited by a UV source are particularly useful. Those compounds having this emission spectra for the compounds makes these compounds particularly useful as pigments in security applications, particularly as pigments for use in security inks and fibers.

  含有芳基脲基苯并噁嗪酮化合物的荧光颜料化合物，其一般式为（I）：其中R1是取代或未取代的芳基，R2和R3各自独立地选自氢原子、烷基、烷氧基、烷基羧基和卤素原子，X是碳或硫原子，n是大于或等于I的整数。这类化合物中的许多产生黄色，通常是深黄色，在适当的紫外光源激发下发射波长约为560至585纳米。这些化合物产生荧光，使它们在荧光颜料中有用，其中那些在被紫外光源激发时提供从约560至585或更高范围内的发射波长的化合物特别有用。这些化合物的发射光谱使它们在安全应用中特别有用，特别是作为安全油墨和纤维用颜料。