Cas no 66335-46-4 (Lithium, [1-(phenylmethyl)-1H-imidazol-2-yl]-)

Lithium, [1-(phenylmethyl)-1H-imidazol-2-yl]- structure
66335-46-4 structure
Product Name:Lithium, [1-(phenylmethyl)-1H-imidazol-2-yl]-
CAS No:66335-46-4
MF:C10H9LiN2
MW:164.132861852646
CID:396465
PubChem ID:12221243
Update Time:2025-04-19

Lithium, [1-(phenylmethyl)-1H-imidazol-2-yl]- Chemical and Physical Properties

Names and Identifiers

    • Lithium, [1-(phenylmethyl)-1H-imidazol-2-yl]-
    • lithium,1-benzyl-2H-imidazol-2-ide
    • 66335-46-4
    • DTXSID80481111
    • SCHEMBL11450426
    • Inchi: 1S/C10H9N2.Li/c1-2-4-10(5-3-1)8-12-7-6-11-9-12;/h1-7H,8H2;/q-1;+1
    • InChI Key: VBXGHIWUUFFURU-UHFFFAOYSA-N
    • SMILES: N1([C-]=NC=C1)CC1C=CC=CC=1.[Li+]

Computed Properties

  • Exact Mass: 163.09179
  • Monoisotopic Mass: 164.09257673g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 195
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 15.6?2

Experimental Properties

  • PSA: 17.82
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