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    BUILDING BLOCK

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    Chemistry

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    Also known as: 1365970-41-7, 2-chloro-3-(1,1-difluoroprop-2-en-1-yl)quinoxaline, Schembl789276
    Molecular Formula
    C11H7ClF2N2
    Molecular Weight
    240.63  g/mol
    InChI Key
    YCGNJFWMEASNEB-UHFFFAOYSA-N
    CAS 1365970-41-7
    1 2D Structure

    CAS 1365970-41-7

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-chloro-3-(1,1-difluoroprop-2-enyl)quinoxaline
    2.1.2 InChI
    InChI=1S/C11H7ClF2N2/c1-2-11(13,14)9-10(12)16-8-6-4-3-5-7(8)15-9/h2-6H,1H2
    2.1.3 InChI Key
    YCGNJFWMEASNEB-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C=CC(C1=NC2=CC=CC=C2N=C1Cl)(F)F
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 1365970-41-7

    2. 2-chloro-3-(1,1-difluoroprop-2-en-1-yl)quinoxaline

    3. Schembl789276

    2.3 Create Date
    2015-02-02
    3 Chemical and Physical Properties
    Molecular Weight 240.63 g/mol
    Molecular Formula C11H7ClF2N2
    XLogP33.5
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count2
    Exact Mass240.0265822 g/mol
    Monoisotopic Mass240.0265822 g/mol
    Topological Polar Surface Area25.8 Ų
    Heavy Atom Count16
    Formal Charge0
    Complexity273
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1

    BUILDING BLOCK

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