5-chloro-2-(2-hydroxy-3-α-cumyl-5-tert-octylphenyl)-2H-benzotriazole | 207738-65-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 5-chloro-2-(2-hydroxy-3-α-cumyl-5-tert-octylphenyl)-2H-benzotriazole
• 英文别名: 5-chloro-2-(2-hydroxy-3-alpha-cumyl-5-tertoctylphenyl)-2H-benzotriazole；2-(5-chlorobenzotriazol-2-yl)-6-(2-phenylpropan-2-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol
• CAS: 207738-65-6
• 化学式: C₂₉H₃₄ClN₃O
• 分子量: 476.061
• InChiKey: GSQIWXJOYBPPGF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.8
• 重原子数：
  34
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  50.9
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  5-chloro-2-(2-hydroxy-3-α-cumyl-5-tert-octylphenyl)-2H-benzotriazole 、 丁硫醇 在 N-甲基吡咯烷酮 、 盐酸 、 氢氧化钾 作用下， 以 水 、 乙酸乙酯 为溶剂， 以83%的产率得到5-n-Butylthio-2-(2-hydroxy-3-α-cumyl-5-tert-octylphenyl)-2H-benzotriazole
  参考文献：
  名称：

  Benzotriazole UV absorbers having enhanced durability

  摘要：

  苯并三唑紫外吸收剂，在苯环的5位被电子吸引基团取代时，当加入到汽车涂料中时表现出增强的耐久性和非常低的损耗率。特别是当苯环的3位也被苯基或苯基烷基（如α-叔丁基）取代时，情况尤为明显。当苯环的5位被全氟烷基（如三氟甲基）取代时，这些化合物特别引人关注，因为它们在某些热塑性组合物中具有增强的耐久性、优异的溶解性和优异的色彩性能，当苯环在3位被氢或叔烷基取代时。

  公开号：

  US06166218A1

文献信息

• [EN] WATER COMPATIBLE STERICALLY HINDERED ALKOXYAMINES AND HYDROXY SUBSTITUTED ALKOXYAMINES<br/>[FR] ALCOXYAMINES STERIQUEMENT ENCOMBREES ET ALCOXYAMINES HYDROXY SUBSTITUEES HYDROCOMPATIBLES
  申请人：CIBA SC HOLDING AG

  公开号：WO2004076419A1

  公开（公告）日：2004-09-10

  Sterically hindered alkoxyamine and hydroxy substituted alkoxyamine stabilizer compounds are made water compatible via certain backbones with affinity towards water. The sterically hindered amines are for example of the formula where for example E and E’ are 2-hydroxycydohexyloxy, 2-hydroxy-2-methylpropoxy, benzyloxy, methoxy, propoxy, hexyloxy, heptyloxy, oclyloxy or cyclohexyloxy, Rx is for example -NH2+CH2CH20H Cl-, -NH3+ -OAc, =NOH, -NHCH(CH3)COO-K+,- NHCH2CH2NH(CH3)2+ -OAC, -NHCH2CH2SO3-K+, -NHCH(COO- K+)CH2CH2SCH3, -NHCH2COO- K+, -OCH(CH3)COO-K+, -OCH2CH2NH(CH3)2+ -OAC, -OCH2CH2SO3-K+, -OCH(COO- K+)CH2CH2SCH3 or -OCH2COO-K+, and where R5 comprises repeating units of -(OCH2CH2)-, -(OCH2CH2(CH3))-,-(CH2CHCOOH)-, -(CH2C(CH3)COOH)-, -(CH2CHCOOCH3)-, -(NHCH2CH2)-, -(CH2CHOH)-, -(CH2CHCONH2)-or -(CH2CH(NHCOH))-. These compounds are particularly effective in stabilizing aqueous polymer systems against the deleterious effects of oxidative, thermal and actinic radiation. The compounds are effective for example in stabilizing water borne coatings, aqueous inks, aqueous inkjet media and photocured aqueous systems.

  通过具有亲水性的特定骨架，使具有立体位阻的烷氧胺和羟基取代的烷氧胺稳定剂化合物与水相容。其中，立体位阻胺的示例为以下公式，其中 E 和 E’ 为 2-羟基环己氧基、2-羟基-2-甲基丙氧基、苄氧基、甲氧基、丙氧基、己氧基、庚氧基、辛氧基或环己氧基，Rx 为例如 -NH2+CH2CH20H Cl-, -NH3+ -OAc, =NOH, -NHCH(CH3)COO-K+,- NHCH2CH2NH(CH3)2+ -OAC, -NHCH2CH2SO3-K+, -NHCH(COO- K+)CH2CH2SCH3, -NHCH2COO- K+, -OCH(CH3)COO-K+, -OCH2CH2NH(CH3)2+ -OAC, -OCH2CH2SO3-K+, -OCH(COO- K+)CH2CH2SCH3 或 -OCH2COO-K+，R5 包括重复单元 -(OCH2CH2)-, -(OCH2CH2(CH3))-,-(CH2CHCOOH)-, -(CH2C(CH3)COOH)-, -(CH2CHCOOCH3)-, -(NHCH2CH2)-, -(CH2CHOH)-, -(CH2CHCONH2)- 或 -(CH2CH(NHCOH))-. 这些化合物在稳定水性聚合物体系抵抗氧化、热和光辐射的有害影响方面特别有效。这些化合物例如在稳定水性涂料、水性油墨、水性喷墨介质和光固化水性系统方面非常有效。
• Processes for the preparation of benzotriazole UV absorbers
  申请人：——

  公开号：US20020035175A1

  公开（公告）日：2002-03-21

  Provided is a process for preparing 2H-benzotriazole UV absorbers containing a perfluoroalkyl moiety at the 5-position of the benzo ring, for example a trifluoromethyl group, which involves diazotizing the perfluoroalkyl substituted o-nitroaniline using concentrated sulfuric acid plus sodium nitrite or nitrosylsulfuric acid to form the corresponding monoazobenzene intermediate via the diazonium salt intermediate which is reduced to the corresponding 5-perfluoroalkyl substituted 2H-benzotriazole UV absorber compound by conventional reduction means. Also provided is a novel one-pot, multiphase reaction for the preparation of 2(2-nitrophenylazo) substituted phenols, which are precursors for 2H-benzotriazole UV absorbers.

  提供了一种制备在苯环的5位含有全氟烷基基团（例如三氟甲基基团）的2H-苯并三唑紫外吸收剂的方法，该方法涉及使用浓硫酸加硝酸钠或亚硝基硫酸制备全氟烷基取代的邻硝基苯胺，以形成相应的单氮偶联苯中间体，通过传统还原手段将二氮盐中间体还原为相应的5-全氟烷基取代的2H-苯并三唑紫外吸收剂化合物。还提供了一种用于制备2(2-硝基苯基偶氮)取代酚的新型一锅多相反应，这些化合物是2H-苯并三唑紫外吸收剂的前体。
• Quinophenanthrine diones fluorescent whitening agents
  申请人：Cole Thurber Damien

  公开号：US20070050927A1

  公开（公告）日：2007-03-08

  Tetrahydro- and dihydroquinophenanthrine dione fluorescent whitening agents and a process for their preparation are provided.

  提供了四氢-和二氢喹诺菲酚酞荧光增白剂及其制备方法。
• Carboxylic acid esters of zosteric acid for prevention of biofouling
  申请人：Elder Todd Stewart

  公开号：US20070128151A1

  公开（公告）日：2007-06-07

  Carboxylic acid ester derivatives of zosteric acid are effective in preventing biofouling and are readily formulated into coatings or films. Coating or film compositions of the esters, and methods for their application, are provided which reduce the dissolution of the esters into water or loss to the environment. The Zosteric acid esters of the invention appear to function by preventing adhesion of an organism to a surface rather than by acute toxic activity rendering said compositions more environmentally acceptable.

  Zosteric酸的羧酸酯衍生物在防止生物污垢方面非常有效，并且很容易制成涂层或薄膜。本发明提供了酯的涂层或薄膜组合物以及其应用方法，其减少了酯在水中的溶解或对环境的损失。本发明的Zosteric酸酯似乎通过防止生物附着在表面上而不是通过急性毒性活性来发挥作用，从而使这些组合物更具环境可接受性。
• Organic solvent-free process for the preparation of 2-(2-nitrophenylazo)phenols
  申请人：Pastor Daniel Stephen

  公开号：US20050053562A1

  公开（公告）日：2005-03-10

  Provided is a novel one-pot, organic solvent-free process for the preparation of 2-(2-nitrophenylazo) substituted phenols. The 2-(2-nitrophenylazo) substituted phenols are precursors for hydroxyphenylbenzotriazole UV absorbers.

  提供了一种新颖的一锅法，无机溶剂的制备2-(2-硝基苯偶氮基)取代酚的过程。这些2-(2-硝基苯偶氮基)取代酚是羟基苯并三唑紫外吸收剂的前体。