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    CAS 27652-89-7

    BUILDING BLOCK

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 27652-89-7, 4-chlorophenyl-2-pyridinylmethanol, Alpha-(4-chlorophenyl)pyridine-2-methanol, Alpha-(4-chlorophenyl)-2-pyridinemethanol, (4-chlorophenyl)-pyridin-2-ylmethanol, 2-pyridinemethanol, alpha-(4-chlorophenyl)-
    Molecular Formula
    C12H10ClNO
    Molecular Weight
    219.66  g/mol
    InChI Key
    ZFUPOFQRQNJDNS-UHFFFAOYSA-N
    FDA UNII
    7WG0AN693Y
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (4-chlorophenyl)-pyridin-2-ylmethanol
    2.1.2 InChI
    InChI=1S/C12H10ClNO/c13-10-6-4-9(5-7-10)12(15)11-3-1-2-8-14-11/h1-8,12,15H
    2.1.3 InChI Key
    ZFUPOFQRQNJDNS-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC=NC(=C1)C(C2=CC=C(C=C2)Cl)O
    2.2 Other Identifiers
    2.2.1 UNII
    7WG0AN693Y
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 27652-89-7

    2. 4-chlorophenyl-2-pyridinylmethanol

    3. Alpha-(4-chlorophenyl)pyridine-2-methanol

    4. Alpha-(4-chlorophenyl)-2-pyridinemethanol

    5. (4-chlorophenyl)-pyridin-2-ylmethanol

    6. 2-pyridinemethanol, Alpha-(4-chlorophenyl)-

    7. 7wg0an693y

    8. Nsc-31264

    9. Nsc-47970

    10. 2-pyridinemethanol,a-(4-chlorophenyl)-

    11. Nsc47970

    12. Einecs 248-592-1

    13. Carbinoxamine Impurity A

    14. Unii-7wg0an693y

    15. Oprea1_370014

    16. Schembl3678911

    17. Dtxsid801286693

    18. (4-chlorophenyl)-2-pyridylmethanol

    19. Albb-025396

    20. Bcp30107

    21. Bha02247

    22. Cs-b0344

    23. Nsc31264

    24. 4-chlorphenyl-(2-pyridyl)-methanol

    25. Mfcd00023493

    26. Nsc 31264

    27. Nsc 47970

    28. Akos003406653

    29. Ac-5509

    30. Ds-4994

    31. Sb47925

    32. Wt80943

    33. 2-(alpha-hydroxy-4-chlorobenzyl)pyridine

    34. Db-022941

    35. A5336

    36. Am20080856

    37. Ft-0651514

    38. (p-chlorophenyl)(2-pyridinyl)methanol

    39. 2-pyridinemethanol, .alpha.-(4-chlorophenyl)-

    40. 652c897

    41. Carbinoxamine Related Compound B [usp-rs]

    42. .alpha.-(4-chlorophenyl)-2-pyridinemethanol

    43. J-016841

    44. Carbinoxamine Related Compound B [usp Impurity]

    45. (s)-(2-pyridinyl)(4-chlorophenyl)methanol Pound>>(s)-alpha-(4-chlorophenyl)pyridine-2-methanol

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 219.66 g/mol
    Molecular Formula C12H10ClNO
    XLogP32.1
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count2
    Exact Mass219.0450916 g/mol
    Monoisotopic Mass219.0450916 g/mol
    Topological Polar Surface Area33.1 Ų
    Heavy Atom Count15
    Formal Charge0
    Complexity192
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1