1-辛基-3-甲基咪唑溴盐

1-octyl-3-methylimidazolium brimide

  • 分子式:C12H23BrN2
  • 分子量:275.23
  • CAS编号:61545-99-1
  • 纯度:98%
  • 基本信息

    产品名称: 1-辛基-3-甲基咪唑溴盐
    英文名称: 1-octyl-3-methylimidazolium bromide
    CAS编号: 61545-99-1       写: OMImBr
    分 子 式 : C12H23BrN2 分 子 量 : 275.23
          度: 98% 产品编号: CP0132
  • 物性数据

    项目 数据 测试条件 备注 数据来源
    表面张力  mN/m 32.5  40℃,101KPa  液体, Ring tensiometer  ILThermo
    密度  g/mL 1.1757  25℃,101KPa  液体, Vibrating tube method  ILThermo
    溶解性   全溶 DMSO 室温 实验实测
    熔点  <65      
    粘度  cP 5068  25℃,101KPa  液体, Cone and plate viscometry  ILThermo
    折光率   1.5241 19.6℃   实验实测
    折光率   1.5221  25℃,101KPa  液体, Standard Abbe refractometry  ILThermo
  • 参考谱图

    1-辛基-3-甲基咪唑溴盐,OMImBr,61545-99-1,1-octyl-3-methylimidazolium bromide,核磁 NMR, H谱, 氘代DMSO
    1-辛基-3-甲基咪唑溴盐,OMImBr,61545-99-1,1-octyl-3-methylimidazolium bromide,核磁 NMR, H谱, 氘代DMSO
    1-辛基-3-甲基咪唑溴盐,OMImBr,61545-99-1,1-octyl-3-methylimidazolium bromide,NMR,H谱

    1-辛基-3-甲基咪唑溴盐,OMImBr,61545-99-1,1-octyl-3-methylimidazolium bromide,NMR,H谱
    Yang, Zhen-Zhen; Advanced Synthesis & Catalysis, (2010), 352(13), 2233-2240, CAplus      

    1-辛基-3-甲基咪唑溴盐,OMImBr,61545-99-1,1-octyl-3-methylimidazolium bromide,NMR,C谱
    1-辛基-3-甲基咪唑溴盐,OMImBr,61545-99-1,1-octyl-3-methylimidazolium bromide,NMR,C谱
    Yang, Zhen-Zhen; Advanced Synthesis & Catalysis, (2010), 352(13), 2233-2240, CAplus
    1-辛基-3-甲基咪唑溴盐,OMImBr,61545-99-1,1-octyl-3-methylimidazolium bromide,ESI-MS
    1-辛基-3-甲基咪唑溴盐,OMImBr,61545-99-1,1-octyl-3-methylimidazolium bromide,ESI-MS
    1-辛基-3-甲基咪唑溴盐,OMImBr,61545-99-1,1-octyl-3-methylimidazolium bromide,ESI-MS
    Yang, Zhen-Zhen; Advanced Synthesis & Catalysis, (2010), 352(13), 2233-2240, CAplus  

     

  • 安全信息

    Code
    Hazard Statement
    Source
    H402
    Harmful to aquatic life
    Expert Curated
    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
    H303
    May be harmful if swallowed
    Expert Curated
  • Other Names and Identifiers

    Canonical SMILES
    [Br-].C1=C[N+](=CN1C)CCCCCCCC
    InChI
    InChI=1S/C12H23N2.BrH/c1-3-4-5-6-7-8-9-14-11-10-13(2)12-14;/h10-12H,3-9H2,1-2H3;1H/q+1;/p-1
    InChI Key
    URVSXZLUUCVGQM-UHFFFAOYSA-M
    6 Other Names for this Substance
    • 1H-Imidazolium, 1-methyl-3-octyl-, bromide (9CI)
    • 1-Methyl-3-octyl-1H-imidazolium bromide
    • 1-Methyl-3-octylimidazolium bromide
    • 1-Octyl-3-methyl imidazolium bromide
    • 3-Methyl-1-octylimidazolium bromide
    • OmimBr
  • 参考文献

    Experimental Properties

    Chemical

    Density

    Electrical

    Flow and Diffusion

    Interface

    Lipinski

    Optical and Scattering

    Structure Related

    Thermal

    Experimental Spectra

    1H-NMR

    13C-NMR

    Additional Spectra

    IR

    Mass

    UV and Visible

    X-Ray