Cas no 76435-44-4 (ethyl 2-fluoro-3-oxohexanoate)

ethyl 2-fluoro-3-oxohexanoate structure
ethyl 2-fluoro-3-oxohexanoate structure
Product Name:ethyl 2-fluoro-3-oxohexanoate
CAS No:76435-44-4
MF:C8H13FO3
MW:176.185426473618
CID:537812
PubChem ID:12646277
Update Time:2025-09-18

ethyl 2-fluoro-3-oxohexanoate Chemical and Physical Properties

Names and Identifiers

    • Hexanoic acid, 2-fluoro-3-oxo-, ethyl ester
    • ethyl 2-fluoro-3-oxohexanoate
    • EN300-1457740
    • ETHYL2-FLUORO-3-OXOHEXANOATE
    • SCHEMBL3778175
    • 76435-44-4
    • DTXSID10505551
    • Inchi: 1S/C8H13FO3/c1-3-5-6(10)7(9)8(11)12-4-2/h7H,3-5H2,1-2H3
    • InChI Key: LNOHNNJHHLKCNM-UHFFFAOYSA-N
    • SMILES: FC(C(=O)OCC)C(CCC)=O

Computed Properties

  • Exact Mass: 176.08489
  • Monoisotopic Mass: 176.08487243g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 6
  • Complexity: 168
  • 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: 1.6
  • Topological Polar Surface Area: 43.4?2

Experimental Properties

  • PSA: 43.37

ethyl 2-fluoro-3-oxohexanoate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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Enamine
EN300-1457740-50mg
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$1020.0 2023-09-29
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EN300-1457740-100mg
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