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    Technical details about CAS 66742-57-2, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 66742-57-2

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    PharmaCompass

    Biophore is a research-driven global pharmaceutical company focused on niche APIs for the generic industry.

    Athena Pharmaceutiques is a Partner of Choice for Drug Delivery & Life Cycle Management.

    2D Structure
    1. Also known as: 66742-57-2, 4-((3-fluorobenzyl)oxy)benzaldehyde, 4-(3-fluoro-benzyloxy)-benzaldehyde, 4-(3-fluorobenzyloxy)benzaldehyde, 4-[(3-fluorobenzyl)oxy]benzaldehyde, 4-(3-fluoro-benzyloxy)benzaldehyde
    Molecular Formula
    C14H11FO2
    Molecular Weight
    230.23  g/mol
    InChI Key
    DNKSIIHRKWTIRH-UHFFFAOYSA-N
    FDA UNII
    F835Z6XML4
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    4-[(3-fluorophenyl)methoxy]benzaldehyde
    2.1.2 InChI
    InChI=1S/C14H11FO2/c15-13-3-1-2-12(8-13)10-17-14-6-4-11(9-16)5-7-14/h1-9H,10H2
    2.1.3 InChI Key
    DNKSIIHRKWTIRH-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC(=CC(=C1)F)COC2=CC=C(C=C2)C=O
    2.2 Other Identifiers
    2.2.1 UNII
    F835Z6XML4
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 66742-57-2

    2. 4-((3-fluorobenzyl)oxy)benzaldehyde

    3. 4-(3-fluoro-benzyloxy)-benzaldehyde

    4. 4-(3-fluorobenzyloxy)benzaldehyde

    5. 4-[(3-fluorobenzyl)oxy]benzaldehyde

    6. 4-(3-fluoro-benzyloxy)benzaldehyde

    7. F835z6xml4

    8. Benzaldehyde, 4-[(3-fluorophenyl)methoxy]-

    9. Benzaldehyde, 4-((3-fluorophenyl)methoxy)-

    10. 4-(3-fluorbenzyloxy)benzaldehyd

    11. Ec 613-982-6

    12. Cambridge Id 6493691

    13. Unii-f835z6xml4

    14. Schembl1347334

    15. Chembl2088923

    16. 4-(3-fluorobenzyloxy)benzaldeyde

    17. Amy4078

    18. Dtxsid40358193

    19. Zinc450399

    20. Albb-001321

    21. Bcp17039

    22. Cs-m0748

    23. Bbl013994

    24. Mfcd02605317

    25. Stk198766

    26. Akos000268837

    27. Gs-5934

    28. Sb17969

    29. Ac-27046

    30. Db-073795

    31. A8983

    32. Bb 0217661

    33. F0943

    34. Ft-0677658

    35. En300-23889

    36. P10230

    37. 4-(3-fluoro-benzyloxy)-benzaldehyde, Aldrichcpr

    38. 742f572

    39. Sr-01000235841

    40. Sr-01000235841-1

    41. 4-(3-fluorobenzyloxy)benzaldehyde;4-((3-fluorobenzyl)oxy)benzaldehyde

    2.4 Create Date
    2005-07-09
    3 Chemical and Physical Properties
    Molecular Weight 230.23 g/mol
    Molecular Formula C14H11FO2
    XLogP32.9
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count4
    Exact Mass230.07430775 g/mol
    Monoisotopic Mass230.07430775 g/mol
    Topological Polar Surface Area26.3 Ų
    Heavy Atom Count17
    Formal Charge0
    Complexity236
    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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