Cas no 87587-77-7 (1-ethyl-3-methylimidazolium chloroaluminate(iii)-kit)

1-ethyl-3-methylimidazolium chloroaluminate(iii)-kit structure
87587-77-7 structure
Product Name:1-ethyl-3-methylimidazolium chloroaluminate(iii)-kit
CAS No:87587-77-7
MF:C6H12N2
MW:112.172881126404
CID:992684
PubChem ID:5245486
Update Time:2025-04-20

1-ethyl-3-methylimidazolium chloroaluminate(iii)-kit Chemical and Physical Properties

Names and Identifiers

    • 1-ethyl-3-methylimidazolium chloroaluminate(iii)-kit
    • 1-ethyl-3-methyl-2H-imidazole
    • [EtMeIm][Al2Cl7]
    • 1-ethyl-3-methylimidazolium heptachloroaluminate
    • 3-ethyl-1-methyl-imidazole
    • EMIM[Al2Cl7]
    • SCHEMBL34730
    • 1-ethyl-3-methylimidazole
    • DTXSID40412901
    • SCHEMBL13756614
    • 87587-77-7
    • Inchi: 1S/C6H12N2/c1-3-8-5-4-7(2)6-8/h4-5H,3,6H2,1-2H3
    • InChI Key: IBZJNLWLRUHZIX-UHFFFAOYSA-N
    • SMILES: N1(C=CN(C)C1)CC

Computed Properties

  • Exact Mass: 112.10000
  • Monoisotopic Mass: 112.100048391g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 1
  • Complexity: 98.7
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1
  • Topological Polar Surface Area: 6.5?2

Experimental Properties

  • PSA: 6.48000
  • LogP: 0.55820

1-ethyl-3-methylimidazolium chloroaluminate(iii)-kit Production Method

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