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4-甲基-N-丁基吡啶双（三氟甲磺酰）亚胺盐

1-Butyl-4-methylpyridinium Bis(trifluoromethanesulfonyl)imide

  • 分子式：C12H16F6N2O4S2
  • 分子量：430.39
  • CAS编号：475681-62-0
  • 纯度：99%

  • 基本信息

    产品名称： 4-甲基-N-丁基吡啶双（三氟甲磺酰）亚胺盐
    英文名称： 1-Butyl-4-methylpyridinium Bis(trifluoromethanesulfonyl)imide
    CAS编号： 475681-62-0 简      写： 4-MBPyTFSI
    分 子 式 ： C12H16F6N2O4S2 分 子 量 ： 430.39
    纯      度： 99% 产品编号： CP1130

  • 物性数据

    项目 数据 测试条件 备注 数据来源
    表面张力  mN/m 35  25℃,101KPa  液体, Ring tensiometer  ILThermo
    电导率  mS/cm 3.41  25℃,101KPa  液体, Alternating current cell with electrodes  ILThermo
    密度  g/mL 1.4122  25℃,101KPa  液体, Vibrating tube method  ILThermo
    密度  g/mL 1.35  20℃,101KPa   SciFinder
    熔点  ℃ 18    DSC/DTA  ILThermo
    熔点  ℃ 10     SciFinder
    粘度  cP 56  25℃,101KPa  液体, Concentric cylinders viscometry  ILThermo
    折光率   1.448  20℃,101KPa  液体, Standard Abbe refractometry  ILThermo

  • 参考谱图

  • 安全信息

    Code
    Hazard Statement
    Source
    H335
    May cause respiratory irritation
    Expert Curated
    H319
    Causes serious eye irritation
    European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling - most common notifications, European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling - most serious notifications, European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling according to CLP criteria, Expert Curated
    H315
    Causes skin irritation
    European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling - most common notifications, European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling - most serious notifications, European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling according to CLP criteria, Expert Curated

  • Other Names and Identifiers

    Canonical SMILES
    O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.C=1C=[N+](C=CC1C)CCCC
    InChI
    InChI=1S/C10H16N.C2F6NO4S2/c1-3-4-7-11-8-5-10(2)6-9-11;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h5-6,8-9H,3-4,7H2,1-2H3;/q+1;-1
    InChI Key
    PQABPVGVABDFHN-UHFFFAOYSA-N
    5 Other Names for this Substance
    • 1-Butyl-4-methylpyridinium bis(trifluoromethylsulfonyl)amide
    • 1-Butyl-4-methylpyridinium bis(trifluoromethylsulfonyl)imide
    • 1-Butyl-4-methylpyridinium N,N-bis(trifluoromethylsulfonyl)amide
    • 4-Methyl-N-butylpyridinium bis(trifluoromethylsulfonyl)imide
    • [Bmpy][NTf2]

  • 参考文献

    Experimental Properties

    Chemical

    Density

    Flow and Diffusion

    Interface

    Thermal

    Experimental Spectra

    1H-NMR

    13C-NMR

    hetero NMR

    IR