3-[(3-methoxypropyl)amino]-2-cyclohexen-1-one | 1419401-83-4

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 3-[(3-methoxypropyl)amino]-2-cyclohexen-1-one
• 英文别名: 3-[(3-Methoxypropyl)amino]-2-cyclohexen-1-one；3-(3-methoxypropylamino)cyclohex-2-en-1-one
• CAS: 1419401-83-4
• 化学式: C₁₀H₁₇NO₂
• 分子量: 183.25
• InChiKey: CYPRITPRLKLGLB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.8
• 重原子数：
  13
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  38.3
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  硫酸二乙酯 、 3-[(3-methoxypropyl)amino]-2-cyclohexen-1-one 以 甲苯 为溶剂， 反应 0.67h， 生成 3-ethoxy-N-(3-methoxypropyl)cyclohex-2-en-1-imine ethyl sulfate
  参考文献：
  名称：

  A cyclic merocyanine UV-A absorber: mechanism of formation and crystal structure

  摘要：

  The product of the reaction of 3-(3-methoxypropylamino)cyclohex-2-en-1-one and diethylsulfate has been crystallized and its structure has been determined by X-ray crystallography. The study allowed insight into the formation mechanism of cyclic merocyanine UV absorbers. X-ray diffraction analysis of the merocyanine product made it possible to define the E/Z-stereoconfiguration. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2014.01.113

文献信息

• MEROCYANINE DERIVATIVES
  申请人：BASF SE

  公开号：US20140150380A1

  公开（公告）日：2014-06-05

  Disclosed are compounds of formula (1) and (2) and/or E/E-, E/Z- or Z/Z geometrical isomer forms thereof; wherein R1-R5, R1-R11 and A are defined as in description. The compounds are used as UV absorbers for protecting household products from photolytic and oxidative degradation, as plastic additives, preferably for food and pharmaceutical packaging applications, for preventing photo-degradation of food by incorporation of the compounds of formula (1′) and/or (2′) into transparent food containers, for protection of UV-A sensitive drugs from photo-degradation by incorporation of UV absorber in transparent blister foils or transparent pharmacy containers, as additives for photographic and printing applications, as additives for electronic applications and protecting the ingredients in agriculture applications.

  揭示的是公式（1）和（2）的化合物和/或其E/E-、E/Z-或Z/Z几何异构体形式；其中R1-R5、R1-R11和A的定义如描述中所述。这些化合物被用作紫外线吸收剂，用于保护家用产品免受光解和氧化降解，作为塑料添加剂，优选用于食品和药品包装应用，通过将公式（1'）和/或（2'）的化合物并入透明食品容器中，防止食物的光降解，通过在透明泡罩箔或透明药品容器中并入紫外线吸收剂，保护UV-A敏感药物免受光降解，作为摄影和印刷应用的添加剂，作为电子应用的添加剂，并保护农业应用中的成分。
• [EN] MEROCYANINE DERIVATIVES<br/>[FR] DÉRIVÉS DE MÉROCYANINE
  申请人：BASF SE

  公开号：WO2013011480A1

  公开（公告）日：2013-01-24

  Disclosed are compounds of formula (1) and (2) and/or E/E-, E/Z- or Z/Z geometrical isomer forms thereof; wherein R1-R5, R1-R11 and A are defined as in description. The compounds are used as UV absorbers for protecting household products from photolytic and oxidative degradation, as plastic additives, preferably for food and pharmaceutical packaging applications, for preventing photo-degradation of food by incorporation of the compounds of formula (1 ') and/or (2') into transparent food containers, for protection of UV-A sensitive drugs from photo-degradation by incorporation of UV absorber in transparent blister foils or transparent pharmacy containers, as additives for photographic and printing applications, as additives for electronic applications and protecting the ingredients in agriculture applications.

  公开了式（1）和（2）的化合物及其E/E-、E/Z-或Z/Z几何异构体形式；其中R1-R5、R1-R11和A的定义如描述中所述。这些化合物被用作紫外线吸收剂，用于保护家庭产品免受光解和氧化降解的影响，作为塑料添加剂，优选用于食品和药品包装应用，通过将式（1'）和/或（2'）的化合物纳入透明食品容器中，防止食品的光降解，通过在透明泡罩箔或透明药房容器中加入紫外线吸收剂来保护对紫外线A敏感的药物免受光降解的影响，作为摄影和印刷应用的添加剂，作为电子应用的添加剂，并保护农业应用中的成分。
• COSMETIC AND/OR DERMATOLOGICAL COMPOSITION CONTAINING A MEROCYANINE DERIVATIVE COMPRISING SPECIFIC POLAR GROUPS CONSISTING OF HYDROXYL- AND ETHER-FUNCTIONALITIES
  申请人：Richard Herve

  公开号：US20140294743A1

  公开（公告）日：2014-10-02

  The present invention relates to a cosmetic and/or dermatological composition comprising in a physiologically acceptable medium at least one merocyanine derivative of formula (1) or (2) and/or its E,E-, E,Z- or Z,Z-geometrical isomer forms: comprising specific polar groups consisting of hydroxyl- and ether-functionalities. Another object of the present invention relates to a cosmetic process for controlling and/or improving the darkening of the skin under exposure to UV radiation and the homogeneity of the colour of the complexion which comprises the application onto the skin of a cosmetic composition as above defined. Another object of the present invention relates to a cosmetic process for protecting the keratinic materials and particularly the skin against photo-ageing which comprises the application onto the keratinic material of a cosmetic composition as above defined.

  本发明涉及一种化妆品和/或皮肤科学组合物，其在生理上可接受的介质中包含至少一种公式（1）或（2）的merocyanine衍生物及/或其E，E-，E，Z-或Z，Z-几何异构体形式：包括由羟基和醚功能团组成的特定极性基团。本发明的另一个目的涉及一种化妆过程，用于控制和/或改善皮肤在紫外线照射下的变黑和肤色均匀性，包括在皮肤上涂抹上述定义的化妆品组合物。本发明的另一个目的涉及一种化妆过程，用于保护角质素材料，特别是皮肤免受光老化的影响，包括在角质素材料上涂抹上述定义的化妆品组合物。
• COSMETIC OR DERMATOLOGICAL COMPOSITION COMPRISING A MEROCYANINE, AN ORGANIC UVB-SCREENING AGENT AND AN ADDITIONAL ORGANIC UVA-SCREENING AGENT
  申请人：L'OREAL

  公开号：US20150366769A1

  公开（公告）日：2015-12-24

  The present invention relates to a cosmetic or dermatological composition comprising, in a physiologically acceptable support: a) at least one oily phase and b) at least one merocyanine compound of formula (1) defined hereinbelow and c) at least one organic UVB-screening agent chosen from: v) a liquid lipophilic organic UVB-screening agent vi) a hydrophilic organic UVB-screening agent vii) a triazine UVB-screening agent and viii) mixtures thereof; and d) at least one organic UVA-screening agent other than the said merocyanine compound; when the said UVB-screening agent is liquid and lipophilic, the said composition contains less than 2% by weight of cyclohexasiloxane relative to the total weight of the composition. Another subject of the present invention consists of a non-therapeutic cosmetic process for caring for and/or making up a keratin material, comprising the application, to the surface of the said keratin material, of at least one composition according to the invention as defined above. The invention also relates to a non-therapeutic cosmetic process for limiting the darkening of the skin and/or improving the colour and/or uniformity of the complexion, comprising the application, to the surface of the keratin material, of at least one composition as defined previously. The invention also relates to a non-therapeutic cosmetic process for preventing and/or treating the signs of ageing of a keratin material, comprising the application, to the surface of the keratin material, of at least one composition as defined previously.

  本发明涉及一种化妆品或皮肤科学组合物，包括在生理上可接受的载体中：a）至少一种油性相和b）至少一种公式（1）所定义的Merocyanine化合物，c）至少一种有机UVB筛选剂，其中包括：v）一种液态亲脂性有机UVB筛选剂，vi）一种亲水性有机UVB筛选剂，vii）三嗪类UVB筛选剂和viii）它们的混合物；d）除所述Merocyanine化合物之外的至少一种有机UVA筛选剂；当所述UVB筛选剂为液态和亲脂性时，所述组合物相对于组合物的总重量含有不到2％的环己二硅氧烷重量。本发明的另一个主题是非治疗性化妆过程，用于护理和/或化妆角蛋白质材料，包括将至少一种根据上述发明定义的组合物应用于所述角蛋白质材料的表面。本发明还涉及一种非治疗性化妆过程，用于限制皮肤变黑和/或改善肤色和/或均匀性，包括将至少一种如上所述的组合物应用于角蛋白质材料的表面。本发明还涉及一种非治疗性化妆过程，用于预防和/或治疗角蛋白质材料的衰老迹象，包括将至少一种如上所述的组合物应用于角蛋白质材料的表面。
• COSMETIC OR DERMATOLOGICAL COMPOSITION COMPRISING A MEROCYANINE AND AN OILY PHASE COMPRISING AT LEAST ONE SPECIFIC AMIDE COMPOUND
  申请人：L'OREAL

  公开号：US20150359718A1

  公开（公告）日：2015-12-17

  The present invention relates to a cosmetic or dermatological composition comprising, in a physiologically acceptable support: a) at least one merocyanine of formula (1) or (2). b) at least one oily phase comprising at least one amide compound of formula (I). The present invention also relates to a non-therapeutic cosmetic process for caring for and/or making up a keratin material, comprising the application, to the surface of the said keratin material, of at least one composition as defined above. The invention also relates to a non-therapeutic cosmetic process for limiting the darkening of the skin and/or improving the colour and/or uniformity of the complexion, comprising the application, to the surface of the keratin material, of at least one composition as defined previously. The invention also relates to a non-therapeutic cosmetic process for preventing and/or treating the signs of ageing of a keratin material, comprising the application, to the surface of the keratin material, of at least one composition as defined previously.

  本发明涉及一种化妆品或皮肤科学组合物，包括在生理上可接受的载体中：a) 至少一种式（1）或（2）的梅洛青素；b) 至少一种油性相，包括至少一种式（I）的酰胺化合物。本发明还涉及一种非治疗性化妆过程，用于护理和/或化妆角蛋白物质，包括将上述至少一种组合物应用于所述角蛋白物质的表面。该发明还涉及一种非治疗性化妆过程，用于限制皮肤变黑和/或改善肤色和/或肤色均匀性，包括将上述至少一种组合物应用于角蛋白物质的表面。该发明还涉及一种非治疗性化妆过程，用于预防和/或治疗角蛋白物质的衰老迹象，包括将上述至少一种组合物应用于角蛋白物质的表面。