CAS: 951163-61-4; Tert-Butyl ((3S,5S)-5-Methylpiperidin-3-yl)Carbamate

该化合物是一个化学化合物,其独特结构包括一个氨基甲酸酯功能组和一个管状林,其特点是化学化合物具有独特的结构,包括一个氨基甲酸功能组和一个管状环.该化合物通常具有与氨基氨和氨基氨相关的特性,例如极地溶剂中潜在的溶性,以及由于氮和氧原子的存在而形成氢联结的能力.(3S,5S)配置所显示的立体化学学表明能够影响其生物活动和相互作用的具体空间安排.作为氨基氨基化合物,它也可能在各种条件下表现出稳定性,尽管在有强酸或碱基的情况下水解作用.二甲基化合物的存在会造成阻塞,这可能会影响化合物的再活性和在生物系统中的紧凑.

英文名称Tert-Butyl ((3S,5S)-5-Methylpiperidin-3-yl)Carbamate
中文名称((3S,5S)-5-甲基哌啶-3-基)氨基甲酸叔丁酯
IUPAC名称tert-butyl ((3S,5S)-5-methylpiperidin-3-yl)carbamate
其它别名((3S,5S)-5-甲基哌啶-3-基)氨基甲酸叔丁酯; Tert-Butyl N-[(3S,5S)-5-Methylpiperidin-3-Yl]Carbamate
CAS编号951163-61-4
MFCD编号:MFCD11112079
EINECS号:846-844-0
分子式:C11H22N2O2
分子量:214.31
产品CID: 2003426
产品分类有机原料→分子砌块→脂肪杂环类化合物→哌啶类化合物

相似结构搜索
InChIKey: CNALVHVMBXLLIY-IUCAKERBSA-N
InChI=1S/C11H22N2O2/c1-8-5-9(7-12-6-8)13-10(14)15-11(2,3)4/h8-9,12H,5-7H2,1-4H3,(H,13,14)/t8-,9-/m0/s1…
计算化学: 氢键受体数3.0氢键供体数2.0可旋转键数1.0

相似化合物

1187055-56-6 1270019-95-8 1203651-07-3

物理性质

沸点313 °C at 760 mmHg
闪点143°C
密度1.00
pKa:12.38±0.40(预测)
PSA:50.36
LogP:1.5091
储存条件2-8°C, protect from light
产品应用该化合物用于治疗自动免疫和炎症的活性酶抑制剂的转基因剂的青霉洛-拉西宁基尿素.

MSDS等安全信息

GHS象形图
GHS符号GHS07 & GHS05;
注释: Exclamation mark & Corrosion
危险类别特定目标器官毒性 - 单次接触类别3
皮肤腐蚀/刺激类别2
严重眼损伤类别1
警示词Danger(危险)
危险描述H335 |可能引起呼吸道刺激.
H315 |造成皮肤刺激.
H318 |造成严重眼损伤.
防范说明P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501
安全声明H303+H313+H333

欧盟法规

C&L通报

上下游产品

N-Boc-(3S,5S)-3-氨基-5-甲基-1-苄基哌啶 (1-Benzyl-5(S)-Methylpiperidin-3(S)-yl)-Carbamic Acid Tert-Butyl Ester 951163-63-6
(2S,4S)-2-Tert-Butoxycarbonylamino-4-Methyl-Pentanedinitrile 1229616-47-0

合成工艺路线路线简述

合成目标产物 Carbamic Acid, N-[(3S,5S)-5-Methyl-3-Piperidinyl]-, 1,1-Dimethylethyl Ester 主要起始原料 Tert-Butyl (3S,5S)-1-Benzyl-5-Methylpiperidin-3-Ylcarbamate
1229616-47-0 = 951163-61-4
反应条件:1.1 Reagents: Benzylamine,Hydrogen,Ammonia Catalysts: Palladium Solvents: Methanol; 80 Psi,Rt
标题:Process For Stereoselective Synthesis Of Piperidine Derivatives Starting From Dialdehydes Or Dinitriles Via Reductive Amination/cyclization As Key Step
参考文献:United States]

951163-63-6 = 951163-61-4
反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Dihydroxide Solvents: Ethanol; 2 H,Rt
标题:Preparation Of Pyrrolopyrazinylureas As Jak Kinase Inhibitors For The Treatment Of Autoimmune And Inflammatory Diseases
参考文献:World Intellectual Property Organization]

951163-63-6 = 951163-61-4
反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethanol,Water; 45 Psi,Rt -> 45 °C
标题:Treatment Of Antibiotic-Resistant Bacteria Infection
参考文献:World Intellectual Property Organization]

951163-63-6 = 951163-61-4
反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethanol,Water; 310 Kpa,Rt -> 45 °C; 310 Kpa,45 °C; 45 °C -> Rt
标题:Process For Preparation Of Quinolone Intermediates
参考文献:China]

951163-63-6 = 951163-61-4
反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethanol; 45 Psi,Rt; 45 Psi,Rt -> 45 °C; 45 °C -> Rt
标题:Process For Preparation Of Quinolinone Derivatives
参考文献:China]

= 951163-61-4 [标题:Reaction Conditions
标题:Pharmaceutical Parenteral Compositions Containing (3S,5S)-7-[3-Amino-5-Methyl-Pyridyl]-1-Cyclopropyl-1,4-Dihydro-8-Methoxy-4-Oxo-3-Carboxylic Acid And Its Application As Antimicrobial Agent
参考文献:China]

= 951163-61-4 [标题:Reaction Conditions
标题:Antimicrobial Parenteral Formulation Containing A Quinolinonecarboxylic Acid Derivative
参考文献:United States]

951163-63-6 = 951163-61-4
反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethanol; 12 H,Rt
标题:Preparation Of Imidazo[1,5-B]Pyridazine Derivatives As Pim Kinase Inhibitors
参考文献:World Intellectual Property Organization]

1229616-47-0 = 951163-61-4
反应条件:1.1 Reagents: Benzylamine,Hydrogen,Ammonia Catalysts: Palladium Solvents: Methanol; 80 Psi,Rt
标题:Stereoselective Synthesis Of Piperidine Derivatives
参考文献:China]

951163-63-6 = 951163-61-4
反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Dihydroxide Solvents: Ethanol; 2 H,1 Atm,Rt
标题:Pyrrolo[2,3-B]Pyrazine Derivatives As Inhibitors Of Janus Kinase And Their Preparation And Use In The Treatment Of Autoimmune And Inflammatory Diseases
参考文献:United States]

1270019-95-8 = 951163-61-4
反应条件:1.1 Solvents: Acetone,Oxalic Acid; Rt; 0.5 H,Rt; 1 H,Rt -> 0 °C1.2 Reagents: Sodium Hydroxide; Ph 101.3 Reagents: (-)-Mandelic Acid Solvents: Acetonitrile; 1 H,Rt; 1 H,Rt -> 0 °C1.4 Reagents: Sodium Hydroxide; Ph 10
标题:Preparation Method Of 3-Substituted-5-Aminopiperidine With Protecting Group
参考文献:China]

951163-63-6 = 951163-61-4
反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethanol,Water; 45 Psi,Rt -> 45 °C
标题:Antibacterial Quinolone For Pneumonia Treatment
参考文献:World Intellectual Property Organization]

951163-63-6 = 951163-61-4
反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethanol; 45 S,Rt -> 45 °C
标题:Antimicrobial Parenteral Formulation Containing A Quinolinonecarboxylic Acid Derivative
参考文献:World Intellectual Property Organization]

951163-63-6 = 951163-61-4
反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethanol,Water; 45 Psi,Rt -> 45 °C; 45 Psi,45 °C; 45 °C -> Rt
标题:Process For Preparation Of Malate Salts And Polycrystalline Of (3S,5S)-7-(3-Amino-5-Methyl-Piperidine-1-Yl)-1-Cyclopropyl-1,4-Dihydro-8-Methoxy-4-Oxo-Quinoline-3-Carboxylic Acid
参考文献:China]

951313-21-6 = 951163-61-4
反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethanol; 45 Psi,Rt -> 45 °C; 45 °C -> Rt
标题:Antibiotic Compositions Containing Malate Salts And Polymorphs Of (3S,5S)-7-[3-Amino-5-Methyl-Piperidinyl]-1-Cyclopropyl-1,4-Dihydro-8-Methoxy-4-Oxo-3-Quinolinecarboxylic Acid
参考文献:World Intellectual Property Organization]

951163-63-6 = 951163-61-4
反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethanol; 45 Psi,45 °C
标题:A Hydride Reduction Process For Preparing Quinolone Intermediates
参考文献:World Intellectual Property Organization]

951163-63-6 = 951163-61-4
反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethanol; 45 Psi,Rt -> 45 °C
标题:A Coupling Process For Preparing Quinolone Intermediates
参考文献:World Intellectual Property Organization

Boc-L-焦谷氨酸甲酯置于palladium 10% On Activated Carbon 氢气,Lithium Hexamethyldisilazane体系中,用四氢呋喃,乙醇作为反应溶剂,-78.0~45.0 °C,268.9 Kpa 条件下,反应 5.75H,反应生成 N-[(3S,5S)-5-甲基-3-哌啶基]-胺基甲酸乙酯-1,1-二甲基乙酯
参考文献: Bicyclic Pyridazine Compounds As Pim Inhibitors[fr] Composés Pyridazines Bicycliques En Tant Qu'Inhibiteurs De Pim
标题: Bicyclic Pyridazine Compounds As Pim Inhibitors[fr] Composés Pyridazines Bicycliques En Tant Qu'Inhibiteurs De Pim
摘要:该发明涉及公式i和i'的双环化合物及其盐.在某些实施例中,该发明涉及pim-1和/或pim-2以及/或pim-3蛋白激酶活性或酶功能的抑制剂或调节剂.在更进一步的实施例中,该发明涉及包含本文披露的化合物的药物组合物,以及它们在预防和治疗pim激酶相关疾病和病症,尤其是癌症中的应用.

海关参考信息

2905122000-异丙醇
2905143000-叔丁醇
2912110000-甲醛
2915110000-甲酸
💡 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-4666945-A
优先权日:1983-11-14
标题:Catalyst composition suitable for synthesis of methanol
发明人：OSUGI MINORU; TAKAGAWA MAKOTO; NAKAMURA TADASI; KOJIMA TAKASHI; TSUJI KINYA
权利人:MITSUBISHI GAS CHEMICAL CO
摘要:A catalyst composition comprising copper oxide, zinc oxide and zirconium oxide, the content of zirconium oxide being 30 to 70% by weight. This catalyst composition is useful for synthesis of methanol from carbon monoxide and/or carbon dioxide and hydrogen by a gas-liquid-solid phase fluidized bed method or a gas-solid phase fluidized bed method.

专利号:US-5627257-A
优先权日:1994-05-27
标题 :Process for the production of polyamides on the basis of Î±,Ï‰-dinitriles
发明人：LIEHR HARTMUT
权利人:ZIMMER AG
摘要:Process for synthesis of spinnable polyamide from Î±, Ï‰-alkyldinitriles and Î±, Ï‰-alkyldiamines and excess water, where a) the aqueous solution of the dinitrile is mixed with a catalytic amount of at least one oxygen-containing acid of phosphorus and/or a water-soluble salt of calcium, zinc, cadmium or manganese in the absence of the diamine, and the pH of this solution is adjusted to an initial value in the range of 2.0 to 4.0 before hydrolysis by adding a saturated aliphatic or aromatic dicarboxylic acid and the dinitrile is and the amide-containing precursors derived therefrom are hydrolyzed to dicarboxylic acid at an elevated temperature under autogenous pressure, whereby the hydrolysis is controlled by conductometric determination of the hydrolysate, and b) at least an equimolar amount of diamine is added to the solution from step a) and the mixture is subjected to polycondensation to form polyamide [nylon].

专利号:US-4547482-A
优先权日:1982-07-21
标题:Catalyst composition suited for synthesis of methanol
发明人：OSUGI MINORU; NAKAMURA TADASI; EBATA SHUJI
权利人:MITSUBISHI GAS CHEMICAL CO
摘要:A catalyst composition comprising copper oxide, zinc oxide and an oxyacid of phosphorus or its salt; and a method for producing methanol by reacting carbon monoxide and/or carbon dioxide with hydrogen in the vapor phase in the presence of a catalyst, wherein the catalyst is the aforesaid catalyst composition which has been activated by reduction with a hydrogen-containing gas.

专利号:US-2025033988-A1
优先权日:2021-12-21
标题 :Synthesis, capping and dispersion of high refractive index nanocrystals and nanocomposites
发明人：WIACEK ROBERT J; MONICKAM SELINA THOMAS; YAZDANPARAST MOHAMMAD SADEGH; SZYCHOWSKI BRIAN; FU GUOYI; GUSCHL PETER CHRISTOPHER; MCCLINTOCK GRACE E M; ZHENG LEI; WILLIAMS ZEHRA SERPIL GONEN; AMIRMOSHIRI MOHAMMADREZA; TADROS NICOLE JOUD
权利人:PT SPE SUBCO LLC
摘要:Preparation of capped metal oxide nanocrystals comprising a metal oxide shell that are photocatalytically and thermally stable and their dispersions in monomers, oligomers, and polymers, as well as the resulting formulations and nanocomposite films. These nanocrystals are highly monodisperse with nanocrystal size between 3-100 n. Resultant formulations incorporating these nanocrystals and a matrix material are highly stable and result in nanocomposites that have high refractive index, are highly transparent, have minimal to no change in absorption upon thermal or UV processing and are optically transparent in the visible wavelengths with very little or no scattering.

专利号:US-5288882-A
优先权日:1992-12-21
标题:Process for recovering an optically active epoxy alcohol
发明人：SHIH T THOMAS; SHUM WILFRED P-S
权利人:ARCO CHEM TECH
摘要:A method of recovering optically active epoxy alcohols from asymmetric epoxidation reaction mixture is provided whereby the epoxy alcohol may be obtained in high yield with minimal degradation of optical purity. The process is also suitable for the synthesis of useful organic sulfonate derivatives of chiral epoxy alcohols.

专利号:CA-2743700-C
优先权日:2008-12-15
标题 :Stereoselective synthesis of piperidine derivatives