Cas no 109239-66-9 (Sodium;5-butylcyclopenta-1,3-diene)

Sodium;5-butylcyclopenta-1,3-diene structure
109239-66-9 structure
Product Name:Sodium;5-butylcyclopenta-1,3-diene
CAS No:109239-66-9
MF:C9H13Na
MW:144.189293622971
CID:1187079
PubChem ID:71334829
Update Time:2025-04-20

Sodium;5-butylcyclopenta-1,3-diene Chemical and Physical Properties

Names and Identifiers

    • sodium,5-butylcyclopenta-1,3-diene
    • 5-butylcyclopenta-1,3-diene
    • sodium
    • 109239-66-9
    • DTXSID20762895
    • Sodium 1-butylcyclopenta-2,4-dien-1-ide
    • Sodium;5-butylcyclopenta-1,3-diene
    • Inchi: 1S/C9H13.Na/c1-2-3-6-9-7-4-5-8-9;/h4-5,7-8H,2-3,6H2,1H3;/q-1;+1
    • InChI Key: PUUAQFVFQDOYBZ-UHFFFAOYSA-N
    • SMILES: [Na+].[C-]1(C=CC=C1)CCCC

Computed Properties

  • Exact Mass: 144.09159
  • Monoisotopic Mass: 144.09149470g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 2
  • Complexity: 65.1
  • 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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