Cas no 25552-08-3 ((5-hydroxy-4-oxo-4H-pyran-2-yl)methyl acetate)

(5-hydroxy-4-oxo-4H-pyran-2-yl)methyl acetate structure
25552-08-3 structure
Product Name:(5-hydroxy-4-oxo-4H-pyran-2-yl)methyl acetate
CAS No:25552-08-3
MF:C8H8O5
MW:184.146122932434
MDL:MFCD18431829
CID:1423426
PubChem ID:12216388
Update Time:2025-10-28

(5-hydroxy-4-oxo-4H-pyran-2-yl)methyl acetate Chemical and Physical Properties

Names and Identifiers

    • 4H-Pyran-4-one, 2-[(acetyloxy)methyl]-5-hydroxy-
    • (5-hydroxy-4-oxopyran-2-yl)methyl acetate
    • (5-hydroxy-4-oxo-4H-pyran-2-yl)methyl acetate
    • AKOS022505458
    • BBL036450
    • VS-13493
    • SCHEMBL11981428
    • EN300-7447581
    • Z1235828823
    • AB88059
    • STL512373
    • DTXSID60480884
    • F2158-2187
    • CS-0260075
    • 25552-08-3
    • MDL: MFCD18431829
    • Inchi: 1S/C8H8O5/c1-5(9)12-3-6-2-7(10)8(11)4-13-6/h2,4,11H,3H2,1H3
    • InChI Key: MWPFSCIYGNZCJP-UHFFFAOYSA-N
    • SMILES: O1C=C(C(C=C1COC(C)=O)=O)O

Computed Properties

  • Exact Mass: 184.03714
  • Monoisotopic Mass: 184.03717335g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 300
  • 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: -0.3
  • Topological Polar Surface Area: 72.8?2

Experimental Properties

  • PSA: 72.83

(5-hydroxy-4-oxo-4H-pyran-2-yl)methyl acetate Pricemore >>

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