CAS: 89-48-5; Rel-(1R,2S,5R)-2-Isopropyl-5-Methylcyclohexyl Acetate

• 英文名称Rel-(1R,2S,5R)-2-Isopropyl-5-Methylcyclohexyl Acetate
• 中文名称乙酸(±)-薄荷酯
• IUPAC名称(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl acetate
• 其它别名1-Isopropyl-4-methylcyclohex-2-yl acetate
• CAS编号89-48-5
• MFCD编号:MFCD00062975
• EINECS号:201-911-8
• 分子式:C12H22O2
• 分子量:198.31
• 产品CID: 1916648
• 产品分类有机原料→通用试剂→有机通用试剂

• 相似结构搜索
• 产品信息参考;;;;
• InChIKey: XHXUANMFYXWVNG-GMUICDJXNA-N
• InChI=1/C12H22O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h8-9,11-12H,5-7H2,1-4H3…
• 计算化学: 氢键受体数2.0氢键供体数0.0可旋转键数2.0

相似化合物

物理性质

• 熔点<25 °C
• 沸点229.1±8.0 °C at 760 mmHg
• 闪点92.2±0.0 °C
• 密度0.9±0.1 g/cm3
• PH:D20 -79.42°
• PSA:26.3
• LogP:3.0103
• 折射率1.448
• 蒸汽压0.1±0.5 mmHg at 25°C
• 溶解性Chloroform (Sparingly), Methanol (Slightly)
• 敏感性常温常压下稳定
• 外观形态无色油状物
• 储存条件-20°C
• 产品应用乙酸薄荷酯(16409-45-3)的用途:GB 2760―1996规定为允许使用的食用香料.其主要用以配制薄荷,水果和浆果类香精.登陆

MSDS等安全信息

• GHS象形图
• GHS符号GHS09;
  注释: Environment
• 危险类别水生慢性毒性 类别2
• 警示词Danger
• 危险描述H411 |对水生生物有毒并具有长期持续影响.
• 防范说明P273-P391-P501
• 危险等级9
• UN编号3082.0
• 危险品标志N
• 包装等级Ⅲ
• 安全声明61
• 危险类别码51/53
• WGK Germany3

欧盟法规

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合成工艺路线路线简述

• 89-78-1 = 89-48-5
  反应条件:1.1 Catalysts: Tin(2+),[5,10,15,20-Tetraphenyl-21H,23H-Porphinato(2-)-Kn21,Kn22,Kn23,Kn24]-,(... Solvents: Acetonitrile; 5 Min,Rt
  标题:Highly Efficient And Selective Acetylation Of Alcohols And Phenols With Acetic Anhydride Catalyzed By A High-Valent Tin(Iv) Porphyrin,Sn(Tpp)(Bf4)2
  作者:Moghadam,Majid; Tangestaninejad,Shahram; Mirkhani,Valiollah; Mohammadpoor-Baltork,Iraj; Taghavi,S. Abdolmanaf
  参考文献:Journal Of Molecular Catalysis A: Chemical 日期:2007 卷标:274(1-2) 页码:217-223]
  
  89-78-1 = 89-48-5
  反应条件:1.1 Catalysts: Lithium Perchlorate
  标题:Lithium Perchlorate Catalyzed Acetylation Of Alcohols Under Mild Reaction Conditions
  作者:Nakae,Yasuyuki; Kusaki,Ikuko; Sato,Tsuneo
  参考文献:Synlett 日期:2001 卷标:(10) 页码:1584-1586]
  
  89-78-1 = 89-48-5
  反应条件:1.1 Catalysts: Scandium Triflate Solvents: Acetonitrile
  标题:Method For Producing Esters
  参考文献:Japan]
  
  89-78-1 = 89-48-5
  反应条件:1.1 Catalysts: Antimony Trichloride; 6 Min,Rt
  标题:Sbcl3 As A Highly Efficient Catalyst For The Acetylation Of Alcohols,Phenols,And Amines Under Solvent-Free Conditions
  作者:Bhattacharya,Asish K.; Diallo,Mamadou A.; Ganesh,Krishna N.
  参考文献:Synthetic Communications 日期:2008 卷标:38(10) 页码:1518-1526]
  
  89-78-1 = 89-48-5
  反应条件:1.1 Catalysts: Ceria,Yttrium Sesquioxide Solvents: Acetonitrile; 4 H,Reflux
  标题:Synthesis Of A Ceria-Yttria Based Strong Lewis Acid Heterogeneous Catalyst: Application To Chemoselective Acylation And Ene Reactions
  作者:Pandey,Rajesh K.; Dagade,Sharda P.; Malase,Kusum M.; Songire,Sachin B.; Kumar,Pradeep
  参考文献:Journal Of Molecular Catalysis A: Chemical 日期:2006 卷标:245(1-2) 页码:255-259]
  
  89-78-1 = 89-48-5
  反应条件:1.1 Catalysts: Manganese(Salen) Chloride Solvents: Toluene
  标题:Mn(Iii) Salen Complex: An Efficient Reusable Acylation Catalyst
  作者:Choudary,B. M.; Kantam,M. L.; Bharathi,B.; Venkat Reddy,C. R.
  参考文献:Journal Of Molecular Catalysis A: Chemical 日期:2001 卷标:168(1-2) 页码:69-73]
  
  89-78-1 = 89-48-5
  反应条件:1.1 Reagents: Diisopropylethylamine Catalysts: 4-(Dimethylamino)Pyridine Solvents: Acetonitrile; 0.5 H,Rt
  标题:Rational Design Of An L-Histidine-Derived Minimal Artificial Acylase For The Kinetic Resolution Of Racemic Alcohols
  作者:Ishihara,Kazuaki; Kosugi,Yuji; Akakura,Matsujiro
  参考文献:Journal Of The American Chemical Society 日期:2004 卷标:126(39) 页码:12212-12213]
  
  89-78-1 = 89-48-5
  反应条件:1.1 Catalysts: (Oc-6-11)-Tris[1,1,1-Trifluoro-N-[(Trifluoromethyl)Sulfonyl-Ko]Methanesulfonamid... Solvents: Acetonitrile
  标题:A New Scandium Complex As An Extremely Active Acylation Catalyst
  作者:Ishihara,Kazuaki; Kubota,Manabu; Yamamoto,Hisashi
  参考文献:Synlett 日期:1996 卷标:(3) 页码:265-6]
  
  108-22-5 + 89-78-1 = 89-48-5
  反应条件:1.1 Catalysts: P-Toluenesulfonic Acid Solvents: Acetonitrile; 17 H,Rt
  标题:Isopropenyl Acetate: A Cheap And General Acylating Agent Of Alcohols Under Metal-Free Conditions
  作者:Temperini,Andrea; Minuti,Lucio; Morini,Tommaso; Rosati,Ornelio; Piazzolla,Francesca
  参考文献:Tetrahedron Letters 日期:2017 卷标:58(43) 页码:4051-4053]
  
  89-78-1 = 89-48-5
  反应条件:1.1 Catalysts: Neodymium Nitrate Hexahydrate; 6 H,405 K
  标题:Preparation Of So42-/fe2O3-Tio2-Nd2O3 Solid Acid And Its Activity For The Synthesis Of Menthyl Acetate
  作者:Yang,Chunhua; Fan,Meiqing; Chen,Gang; Zhang,Long
  参考文献:Journal Of The Chemical Society Of Pakistan 日期:2012 卷标:34(1) 页码:72-75]
  
  89-78-1 = 89-48-5
  反应条件:1.1 Solvents: Water; 9.9 S,5 Mpa,200 °C
  标题:A Highly Selective,High-Speed,And Hydrolysis-Free O-Acylation In Subcritical Water In The Absence Of A Catalyst
  作者:Sato,Masahiro; Matsushima,Keiichiro; Kawanami,Hajime; Ikuhsima,Yutaka
  参考文献:Angewandte Chemie 日期:2007 卷标:46(33) 页码:6284-6288]
  
  89-78-1 = 89-48-5
  反应条件:1.1 Catalysts: Tin(2+),Tetraaquadibutyl-,(Oc-6-11)-,1,5-Naphthalenedisulfonate (1:1); 15 Min,Rt
  标题:Synthesis,Structure And Reactivity Of Hydrated And Dehydrated Organotin Cations
  作者:Chandrasekhar,Vadapalli; Boomishankar,Ramamoorthy; Gopal,Kandasamy; Sasikumar,Palani; Singh,Puja; Et Al
  参考文献:European Journal Of Inorganic Chemistry 日期:2006 卷标:(20) 页码:4129-4136]
  
  89-78-1 = 89-48-5
  反应条件:1.1 Catalysts: Molybdenum Chloride Oxide (Mocl2O2),(T-4)- Solvents: Dichloromethane; Rt; 30 Min,Rt1.2 6 H,Rt1.3 Reagents: Water; Cooled
  标题:Nucleophilic Acyl Substitutions Of Anhydrides With Protic Nucleophiles Catalyzed By Amphoteric,Oxomolybdenum Species
  作者:Chen,Chien-Tien; Kuo,Jen-Huang; Pawar,Vijay D.; Munot,Yogesh S.; Weng,Shieu-Shien; Et Al
  参考文献:Journal Of Organic Chemistry 日期:2005 卷标:70(4) 页码:1188-1197]
  
  89-78-1 = 89-48-5
  反应条件:1.1 Solvents: Acetic Acid
  标题:Liquid Phase Acylation Of Alcohols With Acetic Acid Over Zeolites
  作者:Narender,N.; Srinivasu,P.; Kulkarni,S. J.; Raghavan,K. V.
  参考文献:Synthetic Communications 日期:2000 卷标:30(11) 页码:1887-1893]
  
  89-78-1 = 89-48-5
  反应条件:1.1 Catalysts: 2,8,9-Trimethyl-2,5,8,9-Tetraaza-1-Phosphabicyclo[3.3.3]Undecane Solvents: Tetrahydrofuran1.2 -
  标题:P(Rnch2Ch2)3N: Efficient Catalysts For Transesterifications,Acylations,And Deacylations
  作者:Ilankumaran,Palanichamy; Verkade,J. G.
  参考文献:Journal Of Organic Chemistry 日期:1999 卷标:64(9) 页码:3086-3089]
  
  89-78-1 = 89-48-5
  反应条件:1.1 Catalysts: 2,8,9-Trimethyl-2,5,8,9-Tetraaza-1-Phosphabicyclo[3.3.3]Undecane Solvents: Pentane
  标题:Superbase-Promoted Acylation Of Hindered Alcohols
  作者:D'Sa,Bosco A.; Verkade,John G.
  参考文献:Journal Of Organic Chemistry 日期:1996 卷标:61(9) 页码:2963-6]
  
  89-78-1 = 89-48-5
  反应条件:1.1 Reagents: Triethylamine Catalysts: 1-Methylimidazole Solvents: Dichloromethane; 3 H,Rt
  标题:Practical And Efficient Acylation And Tosylation Of Sterically Hindered Alcohols Catalyzed With 1-Methylimidazole
  作者:Wu,Qin-Pei; Liu,Hua; Liu,Hai-Xia; Chen,Xi; Wang,Hao; Et Al
  参考文献:Chemical Research In Chinese Universities 日期:2010 卷标:26(1) 页码:55-59]
  
  89-78-1 = 89-48-5
  反应条件:1.1 Catalysts: Zinc Acetate; 4 H,Rt1.2 Reagents: Sodium Bicarbonate Solvents: Water; 1 H,Rt
  标题:Acetylation Of Hydroxy Radical Catalyzed By Zn(Aco)2 Using Acetic Anhydride As Solvent
  作者:Xu,Shao-Hong; Yao,Peng
  参考文献:Huaxue Shiji 日期:2009 卷标:31(9) 页码:761-763]
  
  89-78-1 = 89-48-5
  反应条件:1.1 Catalysts: Copper(Ii) Tetrafluoroborate; 30 Min,Rt
  标题:Copper(Ii) Tetrafluoroborate-Catalyzed Acetylation Of Phenols,Thiols,Alcohols,And Amines
  作者:Chakraborti,Asit K.; Gulhane,Rajesh; Shivani
  参考文献:Synthesis 日期:2004 卷标:(1) 页码:111-115

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