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1-腈丙基-3-甲基咪唑氯盐

1-cyanopropyl-3-methylimidazolium chloride

  • 分子式：C8H12ClN3
  • 分子量：185.65
  • CAS编号：683224-96-6
  • 纯度：99%

  • 基本信息

    产品名称： 1-腈丙基-3-甲基咪唑氯盐
    英文名称： 1-cyanopropyl-3-methylimidazolium chloride
    CAS编号： 683224-96-6 简      写： CPMImCl
    分 子 式 ： C8H12ClN3 分 子 量 ： 185.65
    纯      度： 99% 产品编号： CP0462

  • 物性数据

    项目 数据 测试条件 备注 数据来源
    熔点  ℃ 90.3 SciFinder
    熔点  ℃ 90    DSC/DTA  ILThermo

  • 参考谱图

    1-腈丙基-3-甲基咪唑氯盐,CPMImCl,683224-96-6,1-cyanopropyl-3-methylimidazolium chloride,核磁 NMR, H谱, 氘代DMSO
    1-腈丙基-3-甲基咪唑氯盐,CPMImCl,683224-96-6,1-cyanopropyl-3-methylimidazolium chloride,核磁 NMR, H谱, 氘代DMSO
    1-腈丙基-3-甲基咪唑氯盐,CPMImCl,683224-96-6,1-cyanopropyl-3-methylimidazolium chloride,核磁 NMR, C谱, 氘代DMSO
    1-腈丙基-3-甲基咪唑氯盐,CPMImCl,683224-96-6,1-cyanopropyl-3-methylimidazolium chloride,核磁 NMR, C谱, 氘代DMSO

  • 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
    H302
    Harmful if swallowed
    Expert Curated
    EUH032
    Contact with acids liberates very toxic gas
    Expert Curated
    AUH032
    Contact with acids liberates very toxic gas
    Expert Curated

  • Other Names and Identifiers

    Canonical SMILES
    [Cl-].N#CCCC[N+]=1C=CN(C1)C
    InChI
    InChI=1S/C8H12N3.ClH/c1-10-6-7-11(8-10)5-3-2-4-9;/h6-8H,2-3,5H2,1H3;1H/q+1;/p-1
    InChI Key
    HGPSWUJKMXIBKA-UHFFFAOYSA-M
    4 Other Names for this Substance
    • 1H-Imidazolium, 1-(3-cyanopropyl)-3-methyl-, chloride (9CI)
    • 1-(3-Cyanopropyl)-3-methyl-1H-imidazol-3-ium chloride
    • 1-(3-Cyanopropyl)-3-methylimidazolium chloride
    • 1-Methyl-1H-imidazolium-3-butyronitrile chloride

  • 参考文献

    Experimental Properties

    Electrical

    Flow and Diffusion

    Optical and Scattering

    Thermal

    Experimental Spectra

    1H-NMR

    13C-NMR

    IR