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    CAS 1585969-17-0
    Also known as: 1954693-13-0, 1585969-17-0, 5-bromo-2-(5-bromo-2,3-dihydro-1h-indol-2-yl)phenol, Tqp0847, Bcp20018, Bcp20090
    Molecular Formula
    C14H11Br2NO
    Molecular Weight
    369.05  g/mol
    InChI Key
    UEUDUQLMNBTXFJ-UHFFFAOYSA-N
    1 2D Structure

    CAS 1585969-17-0

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    5-bromo-2-(5-bromo-2,3-dihydro-1H-indol-2-yl)phenol
    2.1.2 InChI
    InChI=1S/C14H11Br2NO/c15-9-2-4-12-8(5-9)6-13(17-12)11-3-1-10(16)7-14(11)18/h1-5,7,13,17-18H,6H2
    2.1.3 InChI Key
    UEUDUQLMNBTXFJ-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1C(NC2=C1C=C(C=C2)Br)C3=C(C=C(C=C3)Br)O
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 1954693-13-0

    2. 1585969-17-0

    3. 5-bromo-2-(5-bromo-2,3-dihydro-1h-indol-2-yl)phenol

    4. Tqp0847

    5. Bcp20018

    6. Bcp20090

    7. Cs-b1724

    8. Cs-15326

    9. C13288

    10. Phenol, 5-bromo-2-[(2r)-5-bromo-2,3-dihydro-1h-indol-2-yl]-

    2.3 Create Date
    2017-01-25
    3 Chemical and Physical Properties
    Molecular Weight 369.05 g/mol
    Molecular Formula C14H11Br2NO
    XLogP34.5
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count1
    Exact Mass368.91869 g/mol
    Monoisotopic Mass366.92074 g/mol
    Topological Polar Surface Area32.3 Ų
    Heavy Atom Count18
    Formal Charge0
    Complexity302
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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      (R)-5-bromo-2-(5-bromoindolin-2-yl)phenol

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      Nanjing Clasien Pharmaceutical & Chemical Co., Ltd. is a high-tech enterprise located in Nanjing, the pro...
      Nanjing Clasien Pharmaceutical & Chemical Co., Ltd. is a high-tech enterprise located in Nanjing, the provincial capital of Jiangsu Province, with excellent location and convenient transportation. We are mainly engaged in R & D, production and sales of new drugs, Pesticide and other fine chemicals. We have two R&D centers and a modern production base, can develop and produce new chemical products ranging from kilograms to tons.
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