Cas no 52528-19-5 (Lithium, (3-chloro-3-methyl-1-butynyl)-)

Lithium, (3-chloro-3-methyl-1-butynyl)- structure
52528-19-5 structure
Product Name:Lithium, (3-chloro-3-methyl-1-butynyl)-
CAS No:52528-19-5
MF:C5H6ClLi
MW:108.495140552521
CID:359420
PubChem ID:71365602
Update Time:2025-04-19

Lithium, (3-chloro-3-methyl-1-butynyl)- Chemical and Physical Properties

Names and Identifiers

    • Lithium, (3-chloro-3-methyl-1-butynyl)-
    • lithium,3-chloro-3-methylbut-1-yne
    • 52528-19-5
    • Lithium 3-chloro-3-methylbut-1-yn-1-ide
    • DTXSID40789004
    • Inchi: 1S/C5H6Cl.Li/c1-4-5(2,3)6;/h2-3H3;/q-1;+1
    • InChI Key: NLGIJXBENANGCM-UHFFFAOYSA-N
    • SMILES: ClC(C#[C-])(C)C.[Li+]

Computed Properties

  • Exact Mass: 107.031
  • Monoisotopic Mass: 108.0318063g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 7
  • Rotatable Bond Count: 0
  • Complexity: 87.5
  • 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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