CAS: 932-01-4; 4,4-Dimethylcyclohexanol

• 英文名称4,4-Dimethylcyclohexanol
• 中文名称4,4-二甲基环己-1-醇
• IUPAC名称4,4-dimethylcyclohexan-1-ol
• 其它别名4,4-二甲基环己醇; 4,4-Dimethylcyclohexan-1-Ol
• CAS编号932-01-4
• MFCD编号:MFCD00101954
• EINECS号:800-888-7
• 分子式:C8H16O
• 分子量:128.21
• 产品CID: 1970414
• 产品分类有机原料→分子砌块→脂肪环类化合物→环己烷类化合物

• 相似结构搜索
• 产品信息参考
• InChIKey: VUQOIZPFYIVUKD-UHFFFAOYSA-N
• InChI=1S/C8H16O/c1-8(2)5-3-7(9)4-6-8/h7,9H,3-6H2,1-2H3…
• 计算化学: 氢键受体数1.0氢键供体数1.0可旋转键数0.0

相似化合物

物理性质

• 熔点28°C
• 沸点81 °C at 14 mmHg
• 闪点66.6±10.9°C
• 密度0.9±0.1 g/cm3
• pKa:15.33±0.40(预测)
• PSA:20.23
• LogP:1.9475
• 折射率1.456
• 蒸汽压0.2±0.7 mmHg at 25°C
• 外观形态白色固体
• 储存条件2-8°C

MSDS等安全信息

• GHS象形图
• GHS符号GHS07;
  注释: Exclamation mark
• 危险类别皮肤腐蚀/刺激 类别2
  严重眼刺激 类别2
  特定目标器官毒性 - 单次接触 类别3
  严重眼刺激 类别2A
• 警示词Warning(警告)
• 危险描述H315 |造成皮肤刺激.
  H319 |造成严重眼刺激.
  H335 |可能引起呼吸道刺激.
• 防范说明P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
• 危险品标志Xi
• 安全声明26
• 危险类别码36

欧盟法规

上下游产品

合成工艺路线路线简述

• 4255-62-3 = 932-01-4
  反应条件:1.1 Reagents: Sodium Borohydride Solvents: Methanol
  标题:Orally Active And Brain Permeable Proline Amides As Highly Selective 5Ht2C Agonists For The Treatment Of Obesity
  作者:Liu,Kevin K.-C.; Lefker,Bruce A.; Dombroski,Mark A.; Chiang,Phoebe; Cornelius,Peter; Et Al
  参考文献:Bioorganic & Medicinal Chemistry Letters 日期:2010 卷标:20(7) 页码:2365-2369]
  
  4255-62-3 = 932-01-4
  反应条件:1.1 Reagents: Sodium Borohydride Solvents: Methanol; Cooled; 2 H,Rt
  标题:2-Iodoxybenzenesulfonic Acid As An Extremely Active Catalyst For The Selective Oxidation Of Alcohols To Aldehydes,Ketones,Carboxylic Acids,And Enones With Oxone
  作者:Uyanik,Muhammet; Akakura,Matsujiro; Ishihara,Kazuaki
  参考文献:Journal Of The American Chemical Society 日期:2009 卷标:131(1) 页码:251-262]
  
  = 932-01-4 [标题:Reaction Conditions
  标题:The Contribution Of Charge To Affinity At Functional (M3) Muscarinic Receptors In Guinea Pig Ileum Assessed From The Effects Of The Carbon Analog Of 4-Damp Methiodide
  作者:Barlow,R. B.; Bond,Susan; Holdup,D. W.; Howard,J. A. K.; Mcqueen,D. S.; Et Al
  参考文献:British Journal Of Pharmacology 日期:1992 卷标:106(4) 页码:819-22]
  
  = 932-01-4 [标题:Reaction Conditions
  标题:Palladium Ii Catalyzed Decomposition Of Cyclic Hydroperoxides: A New And Simple Way To α,β-Unsaturated Aldehydes
  作者:Formanek,K.; Aune,J. P.; Jouffret,M.; Metzger,J.
  参考文献:Nouveau Journal De Chimie 日期:1979 卷标:3(5) 页码:311-20]
  
  = 932-01-4 + 4255-62-3 + 1193-47-1 + 2979-19-3 + 767-12-4 + 1193-46-0
  反应条件:1.1 Reagents: Ceric Ammonium Nitrate Catalysts: (Oc-6-43)-[octahydro-1,4-Dimethyl-7-[(2-Pyridinyl-Kn)Methyl]-1H-1,4,7-Triazonine... Solvents: Acetonitrile,Water; 30 Min,0 °C; 30 Min,0 °C1.2 Reagents: Sodium Bicarbonate Solvents: Water; 0 °C
  标题:Iron-Catalyzed C-H Hydroxylation And Olefin Cis-Dihydroxylation Using A Single-Electron Oxidant And Water As The Oxygen-Atom Source
  作者:Garcia-Bosch,Isaac; Codola,Zoel; Prat,Irene; Ribas,Xavi; Lloret-Fillol,Julio; Et Al
  参考文献:Chemistry - A European Journal 日期:2012 卷标:18(42) 页码:13269-13273]
  
  4255-62-3 = 932-01-4
  反应条件:1.1 Reagents: Water Catalysts: Aluminum Nickel Alloy Solvents: Water; 6 H,2.8 Kbar,80 °C
  标题:Selective Reduction Of Ketones Using Water As A Hydrogen Source Under High Hydrostatic Pressure
  作者:Tomin,Anna; Lazarev,Alexander; Bere,Matthew P.; Redjeb,Hana; Toeroek,Bela
  参考文献:Organic & Biomolecular Chemistry 日期:2012 卷标:10(36) 页码:7321-7326]
  
  1073-13-8 = 932-01-4
  反应条件:1.1 Reagents: Sodium Borohydride Catalysts: Cobalt Chloride (Cocl2) Solvents: Water
  标题:Reductions Of α,β-Unsaturated Ketones By Nabh4 Or Nabh4 + Cocl2: Selectivity Control By Water Or By Aqueous Micellar Solutions
  作者:Aramini,Andrea; Brinchi,Lucia; Germani,Raimondo; Savelli,Gianfranco
  参考文献:European Journal Of Organic Chemistry 日期:2000 卷标:(9) 页码:1793-1797]
  
  634905-74-1 = 932-01-4
  反应条件:1.1 Reagents: Triethylborane,Tributylstannane,Oxygen Solvents: Benzene,Tetrahydrofuran; 96 H,Rt1.2 Reagents: Sodium Carbonate Catalysts: Water Solvents: Methanol; Overnight,Reflux
  标题:A Free Radical Method For Reduction Of Cyclohexanones-Preferential Formation Of Equatorial Alcohols
  作者:Clive,Derrick L. J.; Cheng,Hua
  参考文献:Synthetic Communications 日期:2003 卷标:33(11) 页码:1951-1961]
  
  4255-62-3 = 932-01-4
  反应条件:1.1 Catalysts: Alcohol Dehydrogenase
  标题:Enzymic "In Vitro" Reduction Of Ketones. Vii. Reduction Rates And Stereochemistry Of The Hlad Catalyzed Reduction Of 2-Alkylcyclohexanones,Dimethylcyclohexanones,Cycloalkanones And Bicycloalkanones
  作者:Van Osselaer,T. A.; Lemiere,G. L.; Lepoivre,J. A.; Alderweireldt,F. C.
  参考文献:Bulletin Des Societes Chimiques Belges 日期:1980 卷标:89(5) 页码:389-98]
  
  = 932-01-4 [标题:Reaction Conditions
  标题:Preparation Of Quinolinylmethyl- Or Naphthalenemethylpiperidinecarboxylic Acid Derivatives As S1P Modulating Agents
  参考文献:World Intellectual Property Organization]
  
  = 932-01-4 [标题:Reaction Conditions
  标题:The Influence Of Lithium Complexing Agents On The Regioselectivity Of Reductions Of Substituted 2-Cyclohexenones By Lithium Aluminum Hydride And Lithium Borohydride
  作者:Loupy,Andre; Seyden-Penne,Jacqueline
  参考文献:Tetrahedron 日期:1980 卷标:36(13) 页码:1937-42]
  
  = 932-01-4 [标题:Reaction Conditions
  标题:The Effect Of Nonbonded Interactions On The Regioselectivity Of Cyclization Of The 5-Hexenyl Radical
  作者:Beckwith,Athelstan L. J.; Lawrence,Tony
  参考文献:Journal Of The Chemical Society 日期:1979 卷标:(11) 页码:1535-9]
  
  = 932-01-4 [标题:Reaction Conditions
  标题:Steric Effects On The Dissociation Constants Of Acyclic,Mono- And Bicyclic Carboxylic Acids
  作者:Grob,Cyril A.; Schweizer,Thomas; Wenk,Paul; Wild,Rolf S.
  参考文献:Helvetica Chimica Acta 日期:1977 卷标:60(2) 页码:482-94]
  
  = 932-01-4 + 767-12-4 + 1193-46-0
  反应条件:1.1 Reagents: Peracetic Acid Catalysts: Stereoisomer Of Bis(1,1,1-Trifluoromethanesulfonato-Ko)[rel-(3R,9R)-3,6,9-Trimet... Solvents: Acetonitrile; -35 °C1.2 -35 °C
  标题:Trapping A Highly Reactive Nonheme Iron Intermediate That Oxygenates Strong C-H Bonds With Stereoretention
  作者:Serrano-Plana,Joan; Oloo,Williamson N.; Acosta-Rueda,Laura; Meier,Katlyn K.; Verdejo,Begona; Et Al
  参考文献:Journal Of The American Chemical Society 日期:2015 卷标:137(50) 页码:15833-15842]
  
  = 932-01-4 + 4255-62-3 + 2979-19-3 + 1193-46-0
  反应条件:1.1 Reagents: Hydrogen Peroxide Catalysts: Iron (Thymine-1-Acetic Acid Complex) Solvents: Acetonitrile; 10 H,60 °C
  标题:From Dna To Catalysis: A Thymine-Acetate Ligated Non-Heme Iron(Iii) Catalyst For Oxidative Activation Of Aliphatic C-H Bonds
  作者:Al-Hunaiti,Afnan; Raisanen,Minna; Repo,Timo
  参考文献:Chemical Communications (Cambridge 日期:2016 卷标:52(10) 页码:2043-2046

海关参考信息

• 2905122000-异丙醇
  2905142000-仲丁醇
• 💡 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

专利信息

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• ➥ 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