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    CAS 89878-14-8

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    CAS 89878-14-8
    Also known as: 89878-14-8, 3-(diethylboryl)pyridine, Diethyl(3-pyridinyl)borane, Diethyl(pyridin-3-yl)borane, Pyridine, 3-(diethylboryl)-, 3-pyridyldiethylborane
    Molecular Formula
    C9H14BN
    Molecular Weight
    147.03  g/mol
    InChI Key
    OJKBCQOJVMAHDX-UHFFFAOYSA-N
    FDA UNII
    3BC5KW7BC5
    1 2D Structure

    CAS 89878-14-8

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    diethyl(pyridin-3-yl)borane
    2.1.2 InChI
    InChI=1S/C9H14BN/c1-3-10(4-2)9-6-5-7-11-8-9/h5-8H,3-4H2,1-2H3
    2.1.3 InChI Key
    OJKBCQOJVMAHDX-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    B(CC)(CC)C1=CN=CC=C1
    2.2 Other Identifiers
    2.2.1 UNII
    3BC5KW7BC5
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 89878-14-8

    2. 3-(diethylboryl)pyridine

    3. Diethyl(3-pyridinyl)borane

    4. Diethyl(pyridin-3-yl)borane

    5. Pyridine, 3-(diethylboryl)-

    6. 3-pyridyldiethylborane

    7. Diethyl-3-pyridylborane

    8. Diethyl (3-pyridyl)borane

    9. Diethyl-3-pyridylboran

    10. 3-pyridyldiethyl Borane

    11. Diethyl 3-pyridylborane

    12. 3-pyridinyldiethylborane

    13. Diethyl(3pyridyl)borane

    14. (3-pyridyl)diethylborane

    15. 3-diethylboranyl Pyridine

    16. 3-diethylboranyl-pyridine

    17. 3-pyridyl-diethyl Borane

    18. Diethyl 3-pyridyl-borane

    19. Diethyl-3-pyridyl-borane

    20. 3-(diethylboryl)-pyridine

    21. Diethyl-(3-pyridyl)borane

    22. Diethyl (3-pyridyl) Borane

    23. Diethyl-(3-pyridyl)-borane

    24. 3-diethylboropyridine

    25. 3bc5kw7bc5

    26. Diethyl (pyridin-3-yl)borane

    27. Schembl297677

    28. Diethyl(3-pyridyl)borane, 97%

    29. Dtxsid00349087

    30. Bcp04285

    31. Cs-b0611

    32. Ex-a3796

    33. Cx1283

    34. Geo-02614

    35. Mfcd00012348

    36. Akos015842685

    37. Zinc169744811

    38. Ac-22583

    39. Am807097

    40. Ds-14716

    41. Db-009679

    42. D2661

    43. Ft-0624865

    44. A25204

    45. 878d148

    46. J-520309

    2.4 Create Date
    2005-09-18
    3 Chemical and Physical Properties
    Molecular Weight 147.03 g/mol
    Molecular Formula C9H14BN
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count3
    Exact Mass147.1219296 g/mol
    Monoisotopic Mass147.1219296 g/mol
    Topological Polar Surface Area12.9 Ų
    Heavy Atom Count11
    Formal Charge0
    Complexity102
    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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