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    Technical details about 1,4-Dibromobutane, learn more about the structure, uses, toxicity, action, side effects and more

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    1,4-Dibromobutane

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    2D Structure
    1. Also known as: 110-52-1, Tetramethylene dibromide, Butane, 1,4-dibromo-, 1,4-butylene bromide, Tetramethylene bromide, 1,4-dibrombutan
    Molecular Formula
    C4H8Br2
    Molecular Weight
    215.91  g/mol
    InChI Key
    ULTHEAFYOOPTTB-UHFFFAOYSA-N
    FDA UNII
    G49PHR6JFU
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1,4-dibromobutane
    2.1.2 InChI
    InChI=1S/C4H8Br2/c5-3-1-2-4-6/h1-4H2
    2.1.3 InChI Key
    ULTHEAFYOOPTTB-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C(CCBr)CBr
    2.2 Other Identifiers
    2.2.1 UNII
    G49PHR6JFU
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 110-52-1

    2. Tetramethylene Dibromide

    3. Butane, 1,4-dibromo-

    4. 1,4-butylene Bromide

    5. Tetramethylene Bromide

    6. 1,4-dibrombutan

    7. 1,4-dibromo-butane

    8. 1.4-dibromobutane

    9. G49phr6jfu

    10. Dbb

    11. Nsc-71435

    12. Tetramethylenebromide

    13. 1,4-dibrombutan [german]

    14. Alpha,omega-dibromobutane

    15. Ccris 8917

    16. Einecs 203-775-5

    17. Unii-g49phr6jfu

    18. Nsc 71435

    19. Brn 1071199

    20. Ai3-14617

    21. 1,4dibromobutane

    22. 1,4-dibrombutane

    23. 1,4-dibromobutan

    24. 1,4 Dibromobutane

    25. Butane,4-dibromo-

    26. Mfcd00000261

    27. 1, 4-dibromobutane

    28. 1,4 -dibromobutane

    29. 1,4-dibromo Butane

    30. Dibromo-1,4 Butane

    31. 1, 4-dibromo-butane

    32. 1,4-dibromo-n-butane

    33. Brch2ch2ch2ch2br

    34. 1,4-bis(bromanyl)butane

    35. Schembl8484

    36. Wln: E4e

    37. 1,4-dibromobutane, 99%

    38. Dsstox_cid_24364

    39. Dsstox_rid_80172

    40. Nciopen2_003230

    41. Dsstox_gsid_44364

    42. 4-01-00-00267 (beilstein Handbook Reference)

    43. Dibromobutane, 1,4-

    44. 1,4-dibromobutane-[13c4]

    45. Chembl3185714

    46. Dtxsid5044364

    47. Nsc71435

    48. Zinc1696823

    49. Tox21_301070

    50. Bbl027293

    51. Stl280306

    52. Akos000118763

    53. Cs-w020631

    54. Ncgc00248278-01

    55. Ncgc00254971-01

    56. Bp-21423

    57. Cas-110-52-1

    58. Am20080049

    59. D0176

    60. Ft-0606854

    61. D77910

    62. A802208

    63. Q161522

    64. Q-200082

    65. F1908-0120

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 215.91 g/mol
    Molecular Formula C4H8Br2
    XLogP32.5
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count0
    Rotatable Bond Count3
    Exact Mass215.89723 g/mol
    Monoisotopic Mass213.89928 g/mol
    Topological Polar Surface Area0 Ų
    Heavy Atom Count6
    Formal Charge0
    Complexity17.5
    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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