Cas no 63329-92-0 (2,5-Furandione, dihydro-3-(1-methyl-3-pentenyl)-)

2,5-Furandione, dihydro-3-(1-methyl-3-pentenyl)- structure
63329-92-0 structure
Product Name:2,5-Furandione, dihydro-3-(1-methyl-3-pentenyl)-
CAS No:63329-92-0
MF:C10H14O3
MW:182.216363430023
CID:426795
PubChem ID:54429408
Update Time:2025-04-19

2,5-Furandione, dihydro-3-(1-methyl-3-pentenyl)- Chemical and Physical Properties

Names and Identifiers

    • 2,5-Furandione, dihydro-3-(1-methyl-3-pentenyl)-
    • 3-hex-4-en-2-yloxolane-2,5-dione
    • DTXSID90711259
    • 3-(Hex-4-en-2-yl)oxolane-2,5-dione
    • 63329-92-0
    • Inchi: 1S/C10H14O3/c1-3-4-5-7(2)8-6-9(11)13-10(8)12/h3-4,7-8H,5-6H2,1-2H3
    • InChI Key: WGKOOBKMKXRSEC-UHFFFAOYSA-N
    • SMILES: O1C(CC(C1=O)C(C)CC=CC)=O

Computed Properties

  • Exact Mass: 182.09432
  • Monoisotopic Mass: 182.094294304g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 243
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 1
  • XLogP3: 1.7
  • Topological Polar Surface Area: 43.4?2

Experimental Properties

  • PSA: 43.37
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