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    Chemistry

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    Also known as: 2141967-71-5, (3s)-3-(4-bromophenyl)piperidine;hydrochloride, Schembl19459257, Mfcd26544682, (3s)-3-(4-bromophenyl)piperidine hydrochloride
    Molecular Formula
    C11H15BrClN
    Molecular Weight
    276.60  g/mol
    InChI Key
    PUVMREVNYDUTMM-HNCPQSOCSA-N
    CAS 2141967-71-5
    1 2D Structure

    CAS 2141967-71-5

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (3S)-3-(4-bromophenyl)piperidine;hydrochloride
    2.1.2 InChI
    InChI=1S/C11H14BrN.ClH/c12-11-5-3-9(4-6-11)10-2-1-7-13-8-10;/h3-6,10,13H,1-2,7-8H2;1H/t10-;/m1./s1
    2.1.3 InChI Key
    PUVMREVNYDUTMM-HNCPQSOCSA-N
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 2141967-71-5

    2. (3s)-3-(4-bromophenyl)piperidine;hydrochloride

    3. Schembl19459257

    4. Mfcd26544682

    5. (3s)-3-(4-bromophenyl)piperidine Hydrochloride

    2.3 Create Date
    2018-01-29
    3 Chemical and Physical Properties
    Molecular Weight 276.60 g/mol
    Molecular Formula C11H15BrClN
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count1
    Exact Mass Da
    Monoisotopic Mass Da
    Topological Polar Surface Area12
    Heavy Atom Count14
    Formal Charge0
    Complexity152
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2

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