苯-1,2,4-三羧酸三(1-甲基庚基)酯 | 59431-98-0

• 物质功能分类: 化学试剂 - 有机试剂 - 酯类
• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 苯-1,2,4-三羧酸三(1-甲基庚基)酯
• 英文名称: 1,2,4-benzenetricarboxylic acid, tris(2-ethylhexyl) ester
• 英文别名: tris(2-ethylhexyl)mellitate；Tris(1-methylheptyl) benzene-1,2,4-tricarboxylate；trioctan-2-yl benzene-1,2,4-tricarboxylate
• CAS: 59431-98-0
• 化学式: C₃₃H₅₄O₆
• 分子量: 546.788
• InChiKey: UVCNQUKPQSCICG-UHFFFAOYSA-N

物化性质

• 沸点：
  585.0±30.0 °C(Predicted)
• 密度：
  0.992±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  11.4
• 重原子数：
  39
• 可旋转键数：
  24
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.73
• 拓扑面积：
  78.9
• 氢给体数：
  0
• 氢受体数：
  6

文献信息

• C7-C12 SECONDARY ALCOHOL ESTERS OF CYCLOHEXANOIC ACID
  申请人：ExxonMobil Chemical Patents Inc.

  公开号：EP2220154A1

  公开（公告）日：2010-08-25
• C7-C12 Secondary Alcohol Esters of Cyclohexanoic Acid
  申请人：Colle Karla S.

  公开号：US20100305250A1

  公开（公告）日：2010-12-02

  C7-C12 secondary alcohol esters of cyclohexanecarboxylic acids are especially useful as plasticizers for PVC and other plasticizable polymers. In embodiments, these plasticizers are useful in plastisol formulations to help improved processability of flexible PVC material. In other embodiments these same plasticizers can be used in blends with other plasticizers to improve processability. In preferred embodiments these same plasticizers can be used to prepare flexible PVC compounds with enhanced low temperature flexibility, low toxicity, and improved resistance to outdoor aging.
• US8669311B2
  申请人：——

  公开号：US8669311B2

  公开（公告）日：2014-03-11
• [EN] C7-C12 SECONDARY ALCOHOL ESTERS OF CYCLOHEXANOIC ACID<br/>[FR] ESTERS D'ALCOOLS SECONDAIRES EN C7-C12 D'ACIDE CYCLOHEXANOÏQUE
  申请人：EXXONMOBIL CHEM PATENTS INC

  公开号：WO2009070398A1

  公开（公告）日：2009-06-04

  C7-C12 secondary alcohol esters of cyclohexanecarboxylic acids are especially useful as plasticizers for PVC and other plasticizable polymers. In embodiments, these plasticizers are useful in plastisol formulations to help improved processability of flexible PVC material. In other embodiments these same plasticizers can be used in blends with other plasticizers to improve processability. In preferred embodiments these same plasticizers can be used to prepare flexible PVC compounds with enhanced low temperature flexibility, low toxicity, and improved resistance to outdoor aging.