1H-吡唑-4,5-二胺,1-甲基-3-苯基- | 132026-42-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 中文名称: 1H-吡唑-4,5-二胺,1-甲基-3-苯基-
• 英文名称: 4,5-diamino-1-methyl-3-phenyl-1H-pyrazole
• 英文别名: 4,5-diamino-1-methyl-3-phenylpyrazole；4,5-diamino-1-methyl-3-phenyl-pyrazole；4,5-diamino 1-methyl 3-phenyl pyrazole；4,5-diamino 1-methyl-3-phenyl-pyrazole；4,5-diamino-1-methyl-3-phenyl pyrazole；1-methyl-3-phenyl-4,5-diaminopyrazole；1-methyl-3-phenyl-1H-pyrazole-4,5-diamine；2-methyl-5-phenylpyrazole-3,4-diamine
• CAS: 132026-42-7
• 化学式: C₁₀H₁₂N₄
• 分子量: 188.232
• InChiKey: LYEBIHUMFJCIMG-UHFFFAOYSA-N

物化性质

• 沸点：
  394.1±42.0 °C(Predicted)
• 密度：
  1.30±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.9
• 重原子数：
  14
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  69.9
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1H-吡唑-4,5-二胺,1-甲基-3-苯基- 在 盐酸 作用下， 以 乙醇 、 水 为溶剂， 生成 1-methyl-3-phenyl-4,5-diaminopyrazole dihydrochloride
  参考文献：
  名称：

  Composition for dyeing keratin fibers which contain at least one diaminopyrazole, dyeing process, novel diaminopyrazoles and process for their preparation

  摘要：

  该发明涉及一种用于氧化染色角蛋白纤维的新型组合物，包括至少一种特定的二氨基吡唑衍生物，以及使用该组合物的染色过程，新型二氨基吡唑衍生物和其制备过程。

  公开号：

  US06338741B1
• 作为产物：
  描述：

  1H-吡唑-5-胺,1-甲基-4-亚硝基-3-苯基- 在 palladium-on-charcoal 盐酸 、 氢气 作用下， 以 乙醇 、 水 为溶剂， 75.0 ℃ 、1.0 MPa 条件下， 反应 3.0h， 生成 1H-吡唑-4,5-二胺,1-甲基-3-苯基-
  参考文献：
  名称：

  Composition for dyeing keratin fibers which contain at least one diaminopyrazole, dyeing process, novel diaminopyrazoles and process for their preparation

  摘要：

  该发明涉及一种用于氧化染色角蛋白纤维的新型组合物，包括至少一种特定的二氨基吡唑衍生物，以及使用该组合物的染色过程，新型二氨基吡唑衍生物和其制备过程。

  公开号：

  US06338741B1

文献信息

• [EN] DYE COMPOSITION COMPRISING A CATIONIC O-ALKYL-SUBSTITUTED META-PHENYLENEDIAMINE DERIVATIVE<br/>[FR] COMPOSITION DE TEINTURE COMPRENANT UN DÉRIVÉ DE MÉTA-PHÉNYLÈNEDIAMINE CATIONIQUE À SUBSTITUTION ALKYLE O
  申请人：OREAL

  公开号：WO2014026952A1

  公开（公告）日：2014-02-20

  The invention relates to a meta-phenylenediamine compound of formula (I) below, the addition salts thereof with an acid and the solvates thereof: in which: R represents a hydrogen or halogen atom; a C1-C4 alkyl radical; a carboxyl radical or a (C1-C4) alkoxycarbonyl radical, R1 represents a linear C1-C10 alkyl radical substituted with a cationic radical, said alkyl radical being optionally interrupted with one or more oxygen atoms and/or with one or more NR6 groups, said cationic radical being optionally substituted with one or more radicals chosen from C1-C4 alkoxy or C1-C4 (hydroxy )alkyl; R6 represents a hydrogen atom or a linear or branched C1-C4 alkyl radical; An- represents an anion or a mixture of anions which are organic or inorganic and cosmetically acceptable.

  该发明涉及以下式（I）的一个甲苯二胺类化合物，以及其与酸的加合盐和溶剂化合物：其中：R代表氢或卤素原子；一个C1-C4烷基基团；一个羧基或（C1-C4）烷氧羰基基团，R1代表一个线性的C1-C10烷基基团，该基团被一个阳离子基团取代，所述烷基基团可以选择性地被一个或多个氧原子和/或一个或多个NR6基团中断，所述阳离子基团可以选择性地被一个或多个从C1-C4烷氧基或C1-C4（羟基）烷基中选择的基团取代；R6代表氢原子或线性或支链的C1-C4烷基基团；An-代表一个有机或无机且在化妆品中可接受的阴离子或阴离子混合物。
• Novel double para-phenylenediamines joined by a linker arm substituted with at least one group chosen from hydroxyl, alkoxy, and/or amino groups and method of dyeing keratinous fibers
  申请人：Sabelle Stéphane

  公开号：US20070011827A1

  公开（公告）日：2007-01-18

  Disclosed herein is a novel family of double para-phenylenediamines joined by a linker arm comprising at least one substituent chosen from hydroxyl, alkoxy, and/or amino substituents. Also disclosed herein is a dyeing composition comprising, in a medium suitable for dyeing, at least one para-phenylenediamine joined by a linker arm comprising at least one substituent chosen from hydroxyl, alkoxy, and/or amino substituents. Further disclosed herein is a method for dyeing keratin fibers comprising applying such a dyeing composition to the keratin fibers. A multi-compartment kit comprising at least one dyeing composition of the present disclosure and at least one oxidizing composition is also disclosed herein.

  本文揭示了一类新型的双对苯二胺家族，其由至少选择自羟基、烷氧基和/或氨基取代基的连接臂连接在一起。本文还揭示了一种染料组合物，其中在适合染色的介质中，至少有一种通过连接臂连接的对苯二胺，其连接臂包含至少选择自羟基、烷氧基和/或氨基取代基。此外，本文还揭示了一种染色角蛋白纤维的方法，包括将这种染料组合物应用于角蛋白纤维。本文还揭示了一种多室套装，其中至少包括本公告中的染料组合物和至少一种氧化剂组合物。
• NEW AMINOINDOLIZINES, DYEING COMPOSITION COMPRISING AT LEAST ONE AMINOINDOLIZINE, METHODS AND USES THEREOF
  申请人：VIDAL Laurent

  公开号：US20090235467A1

  公开（公告）日：2009-09-24

  A new class of chemical entities chosen from aminoindolizines of formula (I), acid addition salts thereof, and solvates thereof: their use for dyeing keratin fibers, including human keratin fibers such as the hair; dyeing compositions comprising such chemical entities; and to kits containing compositions comprising those chemical entities.

  从式(I)的氨基吲哚啉类化合物中选择的一类新化学实体，其酸加成盐和溶剂化物：它们用于染色角蛋白纤维，包括人类角蛋白纤维，如头发；包含这些化学实体的染料组合物；以及包含含有这些化学实体的组合物的工具包。
• [EN] CATIONIC PARA-PHENYLENEDIAMINES, COMPOSITION COMPRISING AT LEAST SUCH COMPOUNDS, IMPLEMENTATION PROCESS THEREFOR AND USE THEREOF<br/>[FR] PARAPHÉNYLÈNEDIAMINES CATIONIQUES, COMPOSITION COMPRENANT AU MOINS DE TELS COMPOSÉS, PROCÉDÉ DE MISE EN OEUVRE ET UTILISATION
  申请人：OREAL

  公开号：WO2013087934A1

  公开（公告）日：2013-06-20

  The present invention relates to particular cationic paraphenylenediamine compounds of formula (I) below and also to the use thereof for dyeing keratin fibres, in particular human keratin fibres such as the hair. The invention also relates to a dye composition comprising, in a suitable dyeing medium, one or more cationic para-phenylenediamines as defined previously. Finally, the invention relates to a dyeing device using the said composition.

  本发明涉及以下式（I）的特定阳离子对苯二胺化合物，以及其用于染色角蛋白纤维，特别是人类角蛋白纤维如头发的用途。该发明还涉及一种染料组合物，其中在适当的染料介质中包含一个或多个如前所定义的阳离子对苯二胺。最后，该发明涉及使用所述组合物的染色装置。
• N-alkylpolyhydroxylated secondary para-phenylenediamines, dye compositions comprising them, processes, and uses thereof
  申请人：Sabelle Stephane

  公开号：US20060026777A1

  公开（公告）日：2006-02-09

  The present disclosure relates to novel N-alkylpolyhydroxylated secondary para-phenylenediamines, to processes for preparing them, to compositions for dyeing keratin fibers, for example keratin fibers such as the hair, comprising, in a medium that is suitable for dyeing, at least one such secondary para-phenylenediamine. The present disclosure also relates to processes for dyeing keratin fibers with the compositions according to the present disclosure, and to dyeing kits containing such compositions.

  本发明涉及新型N-烷基多羟基化二级对苯二胺，涉及制备它们的方法，涉及用于染色的角蛋白纤维，例如头发的组合物，其包含在适合染色的介质中，至少一种此类二级对苯二胺。本发明还涉及使用根据本发明的组合物对角蛋白纤维进行染色的方法，以及包含此类组合物的染色套装。