Cas no 5453-28-1 (4-(oxolan-2-yl)butyl Tetradecanoate)

4-(oxolan-2-yl)butyl Tetradecanoate structure
5453-28-1 structure
Product Name:4-(oxolan-2-yl)butyl Tetradecanoate
CAS No:5453-28-1
MF:C22H42O3
MW:354.567087650299
CID:941771
PubChem ID:227221
Update Time:2025-04-19

4-(oxolan-2-yl)butyl Tetradecanoate Chemical and Physical Properties

Names and Identifiers

    • 4-(oxolan-2-yl)butyl Tetradecanoate
    • 4-(tetrahydrofuran-2-yl)butyl tetradecanoate
    • AC1L5FC5
    • AG-K-28378
    • AR-1F7289
    • CTK5A1490
    • NSC18565
    • NSC-18565
    • DTXSID20280781
    • 5453-28-1
    • Inchi： 1S/C22H42O3/c1-2-3-4-5-6-7-8-9-10-11-12-18-22(23)25-19-14-13-16-21-17-15-20-24-21/h21H,2-20H2,1H3
    • InChI Key： YNBODGDUUODERH-UHFFFAOYSA-N
    • SMILES： O1CCCC1CCCCOC(CCCCCCCCCCCCC)=O

Computed Properties

  • Exact Mass: 354.31356
  • Monoisotopic Mass: 354.313
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 25
  • Rotatable Bond Count: 18
  • Complexity: 304
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 7.8
  • Topological Polar Surface Area: 35.5?2

Experimental Properties

  • Density: 0.921
  • Boiling Point: 436.1°C at 760 mmHg
  • Flash Point: 165.6°C
  • Refractive Index: 1.459
  • PSA: 35.53
  • LogP: 6.58000

4-(oxolan-2-yl)butyl Tetradecanoate Related Literature

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