Cas no 72636-53-4 (Furan, 2,5-dibutyl-)

Furan, 2,5-dibutyl- structure
Furan, 2,5-dibutyl- structure
Product Name:Furan, 2,5-dibutyl-
CAS No:72636-53-4
MF:C12H20O
MW:180.286603927612
CID:543626
PubChem ID:586437
Update Time:2025-04-19

Furan, 2,5-dibutyl- Chemical and Physical Properties

Names and Identifiers

    • Furan, 2,5-dibutyl-
    • 2,5-dibutylfuran
    • SCHEMBL4312689
    • 2,5-Dibutylfuran #
    • 72636-53-4
    • XTBSCDXJHDVPLX-UHFFFAOYSA-N
    • DTXSID70342989
    • Inchi: 1S/C12H20O/c1-3-5-7-11-9-10-12(13-11)8-6-4-2/h9-10H,3-8H2,1-2H3
    • InChI Key: XTBSCDXJHDVPLX-UHFFFAOYSA-N
    • SMILES: O1C(=CC=C1CCCC)CCCC

Computed Properties

  • Exact Mass: 180.1515
  • Monoisotopic Mass: 180.151415257g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 6
  • Complexity: 108
  • 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: 4.4
  • Topological Polar Surface Area: 13.1?2

Experimental Properties

  • PSA: 13.14

Furan, 2,5-dibutyl- Related Literature

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