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1-丁基磺酸-3-丁基咪唑内盐

1-sulfobutyl-3-butylimidazolium

  • 分子式：C11H20N2O3S
  • 分子量：260.35
  • CAS编号：439937-61-8
  • 纯度：99%

  • 基本信息

    产品名称： 1-丁基磺酸-3-丁基咪唑内盐
    英文名称： 1-sulfobutyl-3-butylimidazolium 
    CAS编号： 439937-61-8 简      写： BSO3HBIm
    分 子 式 ： C11H20N2O3S 分 子 量 ： 260.35
    纯      度： 99% 产品编号： CP0940

  • 物性数据

    项目 数据 测试条件 备注 数据来源
    熔点  ℃ 152     SciFinder

  • 参考谱图

  • 安全信息

    Code
    Hazard Statement
    Source
    H335
    May cause respiratory 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
    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)([O-])CCCC[N+]=1C=CN(C1)CCCC
    InChI
    InChI=1S/C11H20N2O3S/c1-2-3-6-12-8-9-13(11-12)7-4-5-10-17(14,15)16/h8-9,11H,2-7,10H2,1H3
    InChI Key
    DTSDUBQXWJFKTP-UHFFFAOYSA-N
    5 Other Names for this Substance
    • 1-(4-Sulfobutyl)-3-butylimidazolium betaine
    • 1-Butylimidazolium-3-(N-butanesulfonate)
    • 4-(1-Butyl-1H-imidazol-3-ium-3-yl)butane-1-sulfonate
    • 4-(3-Butyl)-imidazolio-1-butanesulfonate
    • 4-(3-Butyl-1-imidazolio)-1-butanesulfonate

  • 参考文献

    Experimental Properties

    Chemical

    Structure Related

    Thermal

    Experimental Spectra

    1H-NMR

    13C-NMR

    Mass