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    Technical details about Bromopivalic Acid, learn more about the structure, uses, toxicity, action, side effects and more

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    Bromopivalic Acid

    INTERMEDIATES

    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: 2843-17-6, 3-bromo-2,2-dimethylpropionic acid, Bromopivalic acid, Propanoic acid, 3-bromo-2,2-dimethyl-, 3-bromo-2,2-dimethyl-propionic acid, Mfcd00055490
    Molecular Formula
    C5H9BrO2
    Molecular Weight
    181.03  g/mol
    InChI Key
    FYHBVTYDATZUEE-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3-bromo-2,2-dimethylpropanoic acid
    2.1.2 InChI
    InChI=1S/C5H9BrO2/c1-5(2,3-6)4(7)8/h3H2,1-2H3,(H,7,8)
    2.1.3 InChI Key
    FYHBVTYDATZUEE-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC(C)(CBr)C(=O)O
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 2843-17-6

    2. 3-bromo-2,2-dimethylpropionic Acid

    3. Bromopivalic Acid

    4. Propanoic Acid, 3-bromo-2,2-dimethyl-

    5. 3-bromo-2,2-dimethyl-propionic Acid

    6. Mfcd00055490

    7. Nsc115937

    8. Beta-bromopivalic Acid

    9. 3-bromo-2,2-dimethylpropionicacid

    10. Schembl314782

    11. Dtxsid50297428

    12. Zinc1705454

    13. 2,2-dimethyl-3-bromopropionic Acid

    14. Ac8762

    15. Akos006343702

    16. 3-bromo-2,2-di Methyl Propanoic Acid

    17. Nsc 115937

    18. Nsc-115937

    19. Bs-12967

    20. Sy139625

    21. Db-017491

    22. Cs-0308255

    23. Ft-0714587

    24. Aq-917/42754027

    25. J-017067

    2.3 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 181.03 g/mol
    Molecular Formula C5H9BrO2
    XLogP31.4
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count2
    Exact Mass179.97859 g/mol
    Monoisotopic Mass179.97859 g/mol
    Topological Polar Surface Area37.3 Ų
    Heavy Atom Count8
    Formal Charge0
    Complexity98.6
    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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