Cas no 62440-16-8 (Lithium, [(4-fluorophenyl)ethynyl]-)

Lithium, [(4-fluorophenyl)ethynyl]- structure
62440-16-8 structure
Product Name:Lithium, [(4-fluorophenyl)ethynyl]-
CAS No:62440-16-8
MF:C8H4FLi
MW:126.056765556335
CID:444676
PubChem ID:13263429
Update Time:2025-04-19

Lithium, [(4-fluorophenyl)ethynyl]- Chemical and Physical Properties

Names and Identifiers

    • Lithium, [(4-fluorophenyl)ethynyl]-
    • lithium,1-ethynyl-4-fluorobenzene
    • DTXSID30532905
    • Lithium 2-(4-fluorophenyl)ethyn-1-ide
    • SCHEMBL18244815
    • 62440-16-8
    • Inchi: 1S/C8H4F.Li/c1-2-7-3-5-8(9)6-4-7;/h3-6H;/q-1;+1
    • InChI Key: XHFBYHDUVISNAU-UHFFFAOYSA-N
    • SMILES: FC1C=CC(C#[C-])=CC=1.[Li+]

Computed Properties

  • Exact Mass: 125.04484
  • Monoisotopic Mass: 126.04570672g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 127
  • 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: 0?2

Experimental Properties

  • PSA: 0
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