CAS: 41693-47-4; 2-Methylhexanoylchloride
该化合物是一种主要用作有机合成中间体的分链氯化物(CAS 52705-93-8),其结构以甲体位置的甲基组为特征,增强了相互碰撞反应的回动性,使其对产生酯类,氨化物和其他衍生物具有价值.化合物的发育障碍可影响某些转化中的选择性.由于水分敏感性,通常在无水条件下处理.应用包括制药和农用化学合成,其量身定制的回活性能够有效地纳入2-甲基丙酸盐混合物.建议适当储存在惰性大气中,并使用适当的安全措施,因为其腐蚀性质和水解潜力.
- 英文名称2-Methylhexanoylchloride
- 中文名称2-甲基己酰氯
- IUPAC名称2-methylhexanoyl chloride
- 其它别名2-Methylhexanoyl Chloride; Hexanoyl Chloride, 2-Methyl-; 2-Methylhexanoylchloride,
- CAS编号41693-47-4
- MFCD编号:MFCD01318644
- 分子式:C7H13ClO分子量:148.63
- 产品CID: 1431028
- 产品分类有机原料 → 羧酸类化合物及衍生物 → 羧酸酰卤化物
- 相似结构搜索
- 产品信息参考
;;;; - InChIKey: WKEBLSOTVYFYKY-UHFFFAOYSA-N
- InChI=1S/C7H13ClO/c1-3-4-5-6(2)7(8)9/h6H,3-5H2,1-2H3
- 计算化学: 氢键受体数1.0氢键供体数*可旋转键数4.0
MSDS等安全信息
上下游产品
2-methylhexanoic acid 3-methylhexanoic acid hexanoic acid 2-methylhexanoylmethylenetriphenylphosphoran (R)-2-methylhexanoic acid (S)-1-phenylethylamide (S)-2-methylhexanoic acid (S)-1-phenylethylamide (+)-(2R)-N-((1'R)-1-phenethyl)-2-methylhexanamide合成工艺路线路线简述
- 合成目标产物 2-Methylhexanoyl Chloride 主要起始原料 2-Methylhexanoic Acid
- (文献来源)合成步骤主要原料 2-Methylhexanoic Acid
📜3-甲基己酸置于三氯化磷体系中,化学反应生成 2-甲基己酰氯
参考文献:Rasetti,Bulletin De La Societe Chimique De France,1905,Vol. <3>33,P. 691
标题:Rasetti,Bulletin De La Societe Chimique De France,1905,Vol. <3>33,P. 691
海关参考信息
- 2912110000-甲醛
2912120000-乙醛
2903110000-一氯甲烷及氯乙烷
2901100000-饱和无环烃 - 💡 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
专利号:US-2007015798-A1
优先权日:2005-02-25
标 题 :Efficient and stereoselective process for large scale synthesis of (3R)-3-(2,3-dihydrobenzofuran-5-yl)-1,2,3,4-tetrahydropyrrolo[3,4-b]quinolin-9-one derivatives
发明人：LI XUN; LEMAIRE SEBASTIEN; MARKO ISTVAN; WILLEMSENS ALBERT
权利人:LI XUN; LEMAIRE SEBASTIEN; MARKO ISTVAN; WILLEMSENS ALBERT
摘要:This invention relates to an efficient process for large scale stereoselective production of (3R)-3-(2,3-dihydrobenzofuran-5-yl)-1,2,3,4-tetrahydropyrrolo[3,4-b]quinolin-9-ones and key intermediates used for the preparation of benzofuranyl pyrroloquinolones as potent and selective PDE5 inhibitors for the treatment of erectile dysfunction, as well as pharmaceutical compositions and methods of treatment utilizing these compounds.
专利号:EP-1851227-A1
优先权日:2005-02-25
标题 :An efficient and stereoselective process for large scale synthesis of 3-(r)-3- (2,3-dihydrobenzofuran-5-yl)-1,2,3,4- tetrahydropyrrolo{3,4-b}quinolin-9-one
专利号:WO-2006093719-A1
优先权日:2005-02-25
标题 :An efficient and stereoselective process for large scale synthesis of 3-(r)-3- (2,3-dihydrobenzofuran-5-yl)-1,2,3,4- tetrahydropyrrolo{3,4-b}quinolin-9-one
专利号:CN-101128468-A
优先权日:2005-02-25
标 题:An efficient and stereoselective process for large scale synthesis of 3-(R)-3- (2,3-dihydrobenzofuran-5-yl)-1,2,3,4- tetrahydropyrrolo{3,4-B}quinolin-9-one
专利号:JP-2008531570-A
优先权日:2005-02-25
标题:Effective and stereoselective large of 3- (R) -3- (2,3-dihydrobenzofuran-5-yl) -1,2,3,4-tetrahydropyrrolo [3,4-B] quinolin-9-one Scale synthesis method
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品牌试剂参考报价(招募中)
📌 第三方产品分析报告
主要参考文献
参考标题:Studies On Hypolipidemic Agents. Ii Synthesis Of 1-Arenesulfonyloxy-2-Alkanone Derivatives As Potent Esterase Inhibitors And Hypolipidemic Agents.作者:Kazuo Ogawa,Tadafumi Terada,Yoshiyuki Muranaka,Toshihiro Hamakawa,Sadao Hashimoto,Setsuro Fujii
摘要:Many 2-Oxoalkyl Arenesulfonate Derivatives Having Straight Or Branched Alkyl Chains Of Different Lengths, 2-Oxoalkyl Bis-Arenesulfonate Derivatives, And Alkyl Arenesulfonate Derivatives Having A Ketal Moiety At The 2-Position On The Alkyl Chain Were Synthesized, And Their Esterase-Inhibitory Activities, As Well As Hypolipidemic Activities, Were Evaluated.Among These Compounds, 1-(2, 4, 6-Trimethylbenzenesulfonyloxy)-2-Dodecanone (Iii-1U), And 1-(2, 3, 4, 6-Tetramethylbenzenesulfonyloxy)-2-Hexanone (Iii-1W), -2-Octanone (Iii-1X) And -2-Decanone (Iii-1Y) Exhibited Potent Esterase-Inhibitory Activities (Ic50=3X10-10, 2X10-10, 2X10<-10> And 3X<-11>M, Respectively). However, The Sulfonate (Xv) Having A Ketal Moiety On The Alkyl Chain And The Bis-Sulfonate (Xvi) Exhibited Low Inhibitory Activities Toward Esterase In Comparison With Iii And Xii. Most Of The Compounds Iii And Some Of The Compounds Xii Exhibited Potent Hypolipidemic Activities Corresponding To More Than 50% Lipid-Lowering Effect (Plasma Triglyceride And Cholesterol Ester) In Vivo. The Structure-Activity Relatioinships Of These Compounds Are Discussed.
合成参考文献
参考文献:10.1007/s11743-003-0275-0
摘要:Stjerndahl M, Holmberg K. Synthesis and chemical hydrolysis of surface‐active esters. J Surfact & Detergents. 2003 Oct;6(4):311–8. doi: 10.1007/s11743-003-0275-0.
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