CAS: 81936-33-6; 4-(Trans-4-Propylcyclohexyl)Phenol

• 英文名称4-(Trans-4-Propylcyclohexyl)Phenol
• 中文名称反式-4-丙基环己基苯酚
• IUPAC名称4-((1s,4r)-4-propylcyclohexyl)phenol
• 其它别名P-(Trans-4-Propylcyclohexyl)Phenol; 4-(Trans-4-N-Propylcyclohexyl)Phenol; 4-Trans-(4-Propylcyclohexyl) Phenol; 4-(Trans-4-Propylcyclohexyl) Phenylacetylene; 4-(Trans-4-N-Propylcyclohexyl)Phenol,3Pcoc15H22O; Trans-4-Propyl Cyclohexyl Phenol; Phenol, 4-(Trans-4-Propylcyclohexyl)-; 2-Cyclohexyl-4-Propylphenol
• CAS编号81936-33-6
• MFCD编号:MFCD00673751
• EINECS号:690-919-9
• 分子式:C15H22O
• 分子量:218.34
• 产品CID: 1811396
• 产品分类Chemistry → Organic Building Blocks → Benzene Compounds | Materials Science → Material Building Blocks → Liquid Crystal (LC) Building Blocks

• 相似结构搜索
• InChIKey: AHAZEMSUUYFDMM-JOCQHMNTNA-N
• InChI=1S/C15H22O/c1-2-3-12-4-6-13(7-5-12)14-8-10-15(16)11-9-14/h8-13,16H,2-7H2,1H3/t12-,13-…
• 计算化学: 氢键受体数1.0氢键供体数1.0可旋转键数3.0

物理性质

• 熔点138°C(文献)
• 沸点339.8±21.0 °C at 760 mmHg
• 闪点176.7±11.5 °C
• 密度1.0±0.1 g/cm3
• pKa:10.21±0.30(预测)
• PSA:20.23
• LogP:5.56
• 折射率1.521
• 蒸汽压0.0±0.8 mmHg at 25°C
• 溶解性Soluble In Methanol
• 外观形态白色至淡黄色粉末至晶体
• 储存条件室温，干燥环境

MSDS等安全信息

• GHS符号GHS07
• 警示词Warning
• 危险描述H302-H315-H319-H335
• 防范说明P261-P305+P351+P338
• 安全声明H413 (100%)

合成工艺路线路线简述

• 86579-53-5 = 81936-33-6
  反应条件:1.1 Reagents: Methyldicyclohexylamine,Water Catalysts: Phenylsilane,Nickel Bromide,[2,2′-Bipyridine]-6,6′-Diamine Solvents: Dimethylacetamide; 12 H,120 °C
  标题:Ni(I)-Catalyzed Hydroxylation Of Aryl Halides With Water Under Thermal Catalysis
  作者:Yang,Liu; Yan,Yonggang; Cao,Ni; Hao,Jing; Li,Gang; Et Al
  参考文献:Organic Letters 日期:2022 卷标:24(51) 页码:9431-9435]
  
  79709-84-5 = 81936-33-6
  反应条件:1.1 Reagents: Boron Tribromide Solvents: Dichloromethane
  标题:The Synthesis And Some Physical Properties Of New Laterally Substituted Phenyl Ethers Containing A Trans-1,4-Disubstituted Cyclohexane Ring
  作者:Kelly,Stephen M.; Schad,Hanspeter
  参考文献:Helvetica Chimica Acta 日期:1985 卷标:68(3) 页码:813-18

海关参考信息

• 2902600000-乙苯
  2902700000-异丙基苯
  2908199090-其他酚的卤化衍生物
  2908999090-其他酚的硝化衍生物
• 💡 提示：海关信息按照顺序优先匹配，如需确认的海关信息，请参考相关资料。
• 详情请参考：📖 海关编码查询和海关进出口税则

其他信息查阅

• ➥ 象形图和危险代码
• ➥ 防范代码详解
• ➥ 危险代码说明
• ➥ Globally Harmonized System
• ➥ REACH监管