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    Chemistry

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    Also known as: 1676-63-7, 1-(4-ethoxyphenyl)ethanone, P-ethoxyacetophenone, 4-ethoxyacetophenone, Ethanone, 1-(4-ethoxyphenyl)-, 1-(4-ethoxyphenyl)ethan-1-one
    Molecular Formula
    C10H12O2
    Molecular Weight
    164.20  g/mol
    InChI Key
    YJFNFQHMQJCPRG-UHFFFAOYSA-N
    FDA UNII
    EWR02SWC14
    4
    1 2D Structure

    4

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-(4-ethoxyphenyl)ethanone
    2.1.2 InChI
    InChI=1S/C10H12O2/c1-3-12-10-6-4-9(5-7-10)8(2)11/h4-7H,3H2,1-2H3
    2.1.3 InChI Key
    YJFNFQHMQJCPRG-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCOC1=CC=C(C=C1)C(=O)C
    2.2 Other Identifiers
    2.2.1 UNII
    EWR02SWC14
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 1676-63-7

    2. 1-(4-ethoxyphenyl)ethanone

    3. P-ethoxyacetophenone

    4. 4-ethoxyacetophenone

    5. Ethanone, 1-(4-ethoxyphenyl)-

    6. 1-(4-ethoxyphenyl)ethan-1-one

    7. 4'-ethoxy Acetophenone

    8. Acetophenone, 4'-ethoxy-

    9. Acetophenone, P-ethoxy-

    10. 4-ethoxyphenylethanone

    11. Mfcd00009095

    12. Ewr02swc14

    13. Nsc-403850

    14. Nsc-406258

    15. 4-acetylphenetole

    16. Unii-ewr02swc14

    17. Nsc 403850

    18. P-ethoxy Acetophenone

    19. Einecs 216-825-6

    20. Nsc 406258

    21. 4'-ethoxy-acetophenone

    22. 4\'-ethoxyacetophenone

    23. Ai3-01029

    24. 4'-ethoxyacetophenone, 98%

    25. Schembl166144

    26. Dtxsid5061873

    27. Zinc159744

    28. Act08128

    29. Ck1149

    30. Nsc403850

    31. Nsc406258

    32. Stl163384

    33. Akos000120844

    34. Am10786

    35. Cs-w013245

    36. Fs-1543

    37. Sy011487

    38. Db-043709

    39. E0458

    40. Ft-0618378

    41. 4 Inverted Exclamation Mark -ethoxyacetophenone

    42. A810888

    43. W-107908

    44. 4'-ethoxyacetophenone, Vetec(tm) Reagent Grade, 98%

    45. Q27277399

    46. F0001-0614

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 164.20 g/mol
    Molecular Formula C10H12O2
    XLogP32.1
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count3
    Exact Mass164.083729621 g/mol
    Monoisotopic Mass164.083729621 g/mol
    Topological Polar Surface Area26.3 Ų
    Heavy Atom Count12
    Formal Charge0
    Complexity146
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1

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