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4,4,5,5-四氟-1-苯基戊烷-1,3-二酮 | 59857-67-9

中文名称
4,4,5,5-四氟-1-苯基戊烷-1,3-二酮
中文别名
——
英文名称
4,4,5,5-tetrafluoro-1-phenylpentane-1,3-dione
英文别名
——
4,4,5,5-四氟-1-苯基戊烷-1,3-二酮化学式
CAS
59857-67-9
化学式
C11H8F4O2
mdl
——
分子量
248.177
InChiKey
OEYWESDBUIZFEW-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    3
  • 重原子数:
    17
  • 可旋转键数:
    5
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.27
  • 拓扑面积:
    34.1
  • 氢给体数:
    0
  • 氢受体数:
    6

SDS

SDS:3a1db10c463fbc20f9a2ac817e7220f0
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反应信息

  • 作为反应物:
    描述:
    4,4,5,5-四氟-1-苯基戊烷-1,3-二酮一水合肼溶剂黄146 作用下, 以 乙醇 为溶剂, 反应 8.0h, 生成 3(5)-(1,1,2,2-tetrafluoroethyl)-5(3)-phenylpyrazole
    参考文献:
    名称:
    多氟烷基吡唑的羟基和烷氧基甲基化
    摘要:
    已经提出了通过 N-未取代的吡唑与多聚甲醛的区域选择性 N-羟基和烷氧基甲基化合成 1-羟基-和 1-烷氧基甲基-3-多氟烷基吡唑的路线。多氟烷基吡唑的烷氧基烷基化在水性醇介质中进行,而羟甲基化需要无水条件。
    DOI:
    10.1007/s11172-018-2104-9
  • 作为产物:
    描述:
    1,1,2,2-tetrafluoro-5-phenyl-5-amino-4-penten-3-one盐酸 作用下, 以 乙醇 为溶剂, 生成 4,4,5,5-四氟-1-苯基戊烷-1,3-二酮 、 alkaline earth salt of/the/ methylsulfuric acid
    参考文献:
    名称:
    Hydrolysis of fluoroalkyl-containing ?-aminovinyl ketones
    摘要:
    The kinetics of hydrolysis of fluoroalkyl-containing beta-aminovinyl ketones R1C(O)CHC(NHR3)R2, in which the substituents CF3 and HCF2CF2 are in the ketone (R1) or enamine parts of the molecule (R2), was studied. In acid (pH < 5) and alkaline (pH > 10) media, they hydrolyze with the formation of the corresponding amines and beta-diketones. In an alkaline medium, the beta-diketones undergo cleavage to fluorinated acids and methyl ketones. The rate constants of hydrolysis in an acid medium change within a range of four orders, depending on the nature of the substituents. The presence of a fluoroalkyl group at the enamine reaction center increases the hydrolysis rate. In an alkaline medium, the rate constants vary within one order.
    DOI:
    10.1007/bf00957999
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文献信息

  • Biginelli condensations of fluorinated 3-oxo esters and 1,3-diketones
    作者:V.I Saloutin、Ya.V Burgart、O.G Kuzueva、C.O Kappe、O.N Chupakhin
    DOI:10.1016/s0022-1139(99)00216-x
    日期:2000.4
    Condensation of fluorinated 3-oxo esters or 1,3-diketones with benzaldehyde and (thio)urea results in the diastereoselective formation of 4-fluoroalkyl-4-hydroxy-2-oxo(thioxo)-6-phenyl-hexahydropyrimidine-5-carboxylates from which by dehydration under acidic conditions the corresponding 6-fluoroalkyl-2-oxo(thioxo)-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylates were obtained. Under the same conditions
    含氟的3-氧代酯或1,3-二酮与苯甲醛和(硫代)脲的缩合导致4-氟烷基-4-羟基-2-羟基-2-氧代(硫代)-6-苯基-六氢嘧啶-5-羧酸酯的非对映选择性形成通过在酸性条件下脱水,得到相应的6-氟烷基-2-氧代(硫代)-4-苯基-1,2,3,4-四氢嘧啶-5-羧酸酯。在相同条件下,六氟乙酰丙酮提供4,6-二羟基-4,6-二(三氟甲基)-六氢嘧啶-2-酮。描述了这些嘧啶衍生物导致稠合杂环的一些其他反应。
  • An Effective Borate-Mediated Approach to 1-Trifluoromethyl-1-hydroxy-3-ketophosphonates, Phosphinates, and Phosphine Oxides
    作者:Dmitrii Chizhov、Vera Vogel、Sergey Tverdomed、Valery Charushin、Gerd-Volker Röschenthaler
    DOI:10.1055/s-0030-1260935
    日期:2011.7
    Ethyl 1-trifluoromethyl-1-hydroxy-3-oxo-phosphonates, the related (methyl)phosphinates and (phenyl)phosphinates, and phosphine oxides were obtained in good yield via direct phosphonylation of acyltrifluoroacetones with diethyl phosphite, ethyl (methyl)phosphonite, ethyl (phenyl)phosphonite, and diphenylphosphine oxide in the presence of triethyl borate. The subsequent dehydration of the selected phosphonates
    1-三氟甲基-1-羟基-3-氧代膦酸乙酯、相关的(甲基)次膦酸和(苯基)次膦酸以及氧化膦通过酰基三氟丙酮与亚磷酸二乙酯、(甲基)亚膦酸乙酯、 (苯基)亚膦酸乙酯和二苯基氧化膦在硼酸三乙酯存在下。选定的膦酸酯和次膦酸酯的后续脱水顺利进行,得到了以前未知的 1,2-不饱和 1-三氟甲基-3-氧代膦酸二乙酯、1-三氟甲基-3-氧代(甲基)- 和 1-三氟甲基-3-氧代乙酯(苯基)次膦酸盐以良好的收率。
  • Condensation of fluoroalkyl-containing 1,3-dicarbonyl compounds with ethylenediamine
    作者:V.I. Saloutin、Z.E. Skryabina、Y.V. Burgart
    DOI:10.1016/s0022-1139(00)81181-1
    日期:1992.3
    interaction of fluoroalkylated 1,3-diketones with ethylenediamine hydroperchlorate; similarly, 1,2,3,4-tetrahydro-1,4-diazepine-5-ones have been obtained from fluorinated 1,3-keto esters. Under mild conditions, fluorinated copper(II) 1,3-diketonates, and copper(II) and nickel(II) N,N′-ethylenebis(aminovinyl ketonates) were found to react with ethylenediamine to form fluoroalkyl-containing N,N′-ethylenebis(aminovinyl
    通过氟烷基化的1,3-二酮与乙二胺氢氯酸盐的直接相互作用制备了2,3-二氢-1 H -1,4-二氮杂pine;类似地,已经从氟化的1,3-酮酯获得了1,2,3,4-四氢-1,4-二氮杂-5-酮。在温和的条件下,发现氟化的1,3-二酮铜(II)和N(N)的铜(II)和N'-亚乙基双(氨基乙烯基酮)会与乙二胺反应生​​成含氟烷基的N,N' -亚乙基双(氨基乙烯基酮)和/或2,3-二氢-1 H -1,4-二氮杂s 。
  • INHIBITORS OF FILOVIRUS ENTRY INTO HOST CELLS
    申请人:Basu Arnab
    公开号:US20120189614A1
    公开(公告)日:2012-07-26
    Organic compounds showing the ability to inhibit viral glycoprotein (GP)-mediated entry of a filovirus into a host cell are disclosed. The disclosed filovirus entry inhibitor compounds are useful for treating, preventing, or reducing the spread of infections by filovirus including the type species Marburg virus (MARV) and Ebola virus (EBOV). Preferred inhibitors of the invention provide therapeutic agents for combating the Ivory Coast, Sudan, Zaire, Bundibugyo, and Reston Ebola virus strains.
    本发明揭示了有机化合物,表现出抑制病毒糖蛋白(GP)介导的菲罗病毒进入宿主细胞的能力。所揭示的菲罗病毒进入抑制剂化合物可用于治疗、预防或减少菲罗病毒感染的传播,包括类型种马尔堡病毒(MARV)和埃博拉病毒(EBOV)。本发明的优选抑制剂为治疗象牙海岸、苏丹、扎伊尔、邦迪布吉奥和雷斯顿埃博拉病毒株提供治疗剂。
  • ——
    作者:E. Suloeva、M. Yure、E. Gudriniece、M. Petrova、A. Gutcaits
    DOI:10.1023/a:1012455709358
    日期:——
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