三(3-丙-2-基苯基)磷酸酯 | 72668-27-0

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 有机磷酸及其衍生物
• 中文名称: 三(3-丙-2-基苯基)磷酸酯
• 中文别名: 咪唑并[1,2-a]吡嗪,2-乙基-5,6,7,8-四氢-(9CI)
• 英文名称: tris(3-isopropylphenyl) phosphate
• 英文别名: Tris-(m-isopropylphenyl)phosphat；tris(3-propan-2-ylphenyl) phosphate
• CAS: 72668-27-0
• 化学式: C₂₇H₃₃O₄P
• 分子量: 452.53
• InChiKey: HZZVNABLNATHQO-UHFFFAOYSA-N

物化性质

• 沸点：
  238 °C(Press: 2 Torr)
• 密度：
  1.108±0.06 g/cm3(Predicted)
• 溶解度：
  可溶于丙酮（少许）、DMSO（少许）、甲醇（少许）

计算性质

• 辛醇/水分配系数(LogP)：
  8.3
• 重原子数：
  32
• 可旋转键数：
  9
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  44.8
• 氢给体数：
  0
• 氢受体数：
  4

安全信息

• 海关编码：
  2919900090

反应信息

• 作为产物：
  描述：

  3-异丙基苯酚 、 三氯氧磷 生成 三(3-丙-2-基苯基)磷酸酯
  参考文献：
  名称：

  Effects of triaryl phosphates on mouse and human nuclear receptors

  摘要：

  The constitutively active receptor (CAR) is a crucial regulator of genes encoding for enzymes active in drug/steroid oxidation, conjugation, and transport. In our attempt to isolate the endogenous inhibitory ligand(s) for the mouse CAR, we found surprisingly that the inhibitory activity was associated with di- and tri-isopropylated phenyl phosphates that were present in livers of untreated mice. Transactivation experiments in mammalian cells with synthetic compounds verified that mouse CAR was inhibited by various isopropylated phenyl phosphates (40-80%). Such triaryl phosphates are widely used as fire retardants, lubricants, and plasticizers, and some of them are known to disturb reproduction by currently unknown mechanisms. Equipped with the finding that these compounds could interact with mouse CAR, we proceeded to determine their functional effects on other nuclear receptors. Human CAR and pregnane X receptor (PXR) were variably activated (2-5-fold) by triaryl phosphates while mouse PXR, peroxisome proliferator-activated receptor-alpha, and vitamin D receptor were refractory. Among steroid hormone receptors, the human androgen receptor was inhibited by triphenyl phosphate and di-ortho-isopropylated phenyl phosphate (40-50%) and activated by di- and tri-para-substituted phenyl phosphates (2-fold). Our results add to the list of CAR and PXR activators and suggest steroid-dependent biological pathways that may contribute to the reproductive effects of triaryl phosphates. (C) 2003 Elsevier Inc. All rights reserved.

  DOI：

  10.1016/j.bcp.2003.08.037

文献信息

• Low Triphenylphosphate, High Phosphorous Content Isopropyl Phenyl Phosphates With High Ortho Alkylation
  申请人：Layman William J.

  公开号：US20120004438A1

  公开（公告）日：2012-01-05

  The present invention relates to low triphenyl phosphate, high phosphorous content aryl phosphates with high ortho alkylation that are suitable for use as flame retardant compositions, processes for their preparation, and their use as flame retardants.

  本发明涉及低三苯基磷酸酯、高磷含量芳基磷酸酯，具有高度正位烷基化，适用于用作阻燃剂组合物，以及其制备过程和用作阻燃剂的用途。
• LOW TRIPHENYLPHOSPHATE, HIGH PHOSPHOROUS CONTENT ISOPROPYL PHENYL PHOSPHATES WITH HIGH ORTHO ALKYLATION
  申请人：Albemarle Corporation

  公开号：EP2021347A2

  公开（公告）日：2009-02-11
• USE OF LOW TRIPHENYLPHOSPHATE, HIGH PHOSPHOROUS CONTENT ISOPROPYL PHENYL PHOSPHATES AS FLAME RETARDANTS IN RESINS
  申请人：Albemarle Corporation

  公开号：EP2134782A1

  公开（公告）日：2009-12-23
• USE OF LOW TRIPHENYLPHOSPHATE, HIGH PHOSPHOROUS CONTENT ISOPROPYL PHENYL PHOSPHATES AS FLAME RETARDANTS IN POLYURETHANE OR POLYISOCYANURATE FOAMS
  申请人：Albemarle Corporation

  公开号：EP2134781A1

  公开（公告）日：2009-12-23
• FLAME RETARDED TEXTILE PRODUCTS AND A METHOD OF MAKING THE SAME
  申请人：Loos Manon

  公开号：US20090325441A1

  公开（公告）日：2009-12-31

  Textile products having a flame retarded coating wherein the flame retarded coating contains a flame-retarding agent.