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    2-Bromo-1-(4-Chlorophenyl)Propan-1-One manufacturers and suppliers on PharmaCompass

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    BUILDING BLOCK

    PharmaCompass

    Chemistry

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    Also known as: 877-37-2, 1-propanone,2-bromo-1-(4-chlorophenyl)-, 2-bromo-1-(4-chloro-phenyl)-propan-1-one, 2-bromo-4'-chloropropiophenone, 2-bromo-1-(4-chlorophenyl)-propan-1-one, 2-bromo-4-chloropropiophenone
    Molecular Formula
    C9H8BrClO
    Molecular Weight
    247.51  g/mol
    InChI Key
    SAKMPXRILWVZEG-UHFFFAOYSA-N
    2-Bromo-1-(4-Chlorophenyl)Propan-1-One
    1 2D Structure

    2-Bromo-1-(4-Chlorophenyl)Propan-1-One

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-bromo-1-(4-chlorophenyl)propan-1-one
    2.1.2 InChI
    InChI=1S/C9H8BrClO/c1-6(10)9(12)7-2-4-8(11)5-3-7/h2-6H,1H3
    2.1.3 InChI Key
    SAKMPXRILWVZEG-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC(C(=O)C1=CC=C(C=C1)Cl)Br
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 877-37-2

    2. 1-propanone,2-bromo-1-(4-chlorophenyl)-

    3. 2-bromo-1-(4-chloro-phenyl)-propan-1-one

    4. 2-bromo-4'-chloropropiophenone

    5. 2-bromo-1-(4-chlorophenyl)-propan-1-one

    6. 2-bromo-4-chloropropiophenone

    7. Schembl634548

    8. 4'-chloro-2-bromopropiophenone

    9. Dtxsid50396420

    10. 4'-chloro-alpha-bromopropiophenone

    11. Mfcd00018687

    12. Stk208501

    13. Akos000118638

    14. Akos016050184

    15. (4-chlorophenyl)-(1-bromoethyl)-ketone

    16. Bs-13570

    17. Cs-0038379

    18. Ft-0691566

    19. En300-04458

    20. W12152

    21. A842356

    2.3 Create Date
    2005-09-11
    3 Chemical and Physical Properties
    Molecular Weight 247.51 g/mol
    Molecular Formula C9H8BrClO
    XLogP33.4
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count2
    Exact Mass245.94471 g/mol
    Monoisotopic Mass245.94471 g/mol
    Topological Polar Surface Area17.1 Ų
    Heavy Atom Count12
    Formal Charge0
    Complexity164
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1

    BUILDING BLOCK

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