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    BUILDING BLOCK

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    Chemistry

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    Also known as: 3-(4-fluorophenyl)-2-methylpropanoyl chloride, 1017183-70-8, Ec 426-370-7, Dtxsid30893609, Mfcd09894790, Akos015945847
    Molecular Formula
    C10H10ClFO
    Molecular Weight
    200.64  g/mol
    InChI Key
    HJOAOPVBPDCOFZ-UHFFFAOYSA-N
    CAS 1017183-70-8
    1 2D Structure

    CAS 1017183-70-8

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3-(4-fluorophenyl)-2-methylpropanoyl chloride
    2.1.2 InChI
    InChI=1S/C10H10ClFO/c1-7(10(11)13)6-8-2-4-9(12)5-3-8/h2-5,7H,6H2,1H3
    2.1.3 InChI Key
    HJOAOPVBPDCOFZ-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC(CC1=CC=C(C=C1)F)C(=O)Cl
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 3-(4-fluorophenyl)-2-methylpropanoyl Chloride

    2. 1017183-70-8

    3. Ec 426-370-7

    4. Dtxsid30893609

    5. Mfcd09894790

    6. Akos015945847

    7. 3-(4-fluorophenyl)-2-methylpropanoylchloride

    8. J-650238

    2.3 Create Date
    2008-02-29
    3 Chemical and Physical Properties
    Molecular Weight 200.64 g/mol
    Molecular Formula C10H10ClFO
    XLogP33.3
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count3
    Exact Mass200.0404208 g/mol
    Monoisotopic Mass200.0404208 g/mol
    Topological Polar Surface Area17.1 Ų
    Heavy Atom Count13
    Formal Charge0
    Complexity176
    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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