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    Technical details about Halquinols, learn more about the structure, uses, toxicity, action, side effects and more

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    Halquinols

    APIs // Active Pharmaceutical Ingredients

    INTERMEDIATES

    PharmaCompass

    Symbiotec: Global API manufacturer, specializing in Cortico-Steroids & Steroid-Hormone APIs.

    Metrochem has been delivering customized volume & quality products to customers across the world, taking utmost care of their needs.

    2D Structure
    1. Also known as: Sq 16,401, 5-chloroquinolin-8-ol;7-chloroquinolin-8-ol;5,7-dichloroquinolin-8-ol, Tarquinor, 8-quinolinol, 5,7-dichloro-, mixt. with 5-chloro-8-quinolinol and 7-chloro-8-quinolinol, Halquinols [usan], Unii-z7z4bx535u
    Molecular Formula
    C27H17Cl4N3O3
    Molecular Weight
    573.2  g/mol
    InChI Key
    XCQBENAYFZFNAR-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    5-chloroquinolin-8-ol;7-chloroquinolin-8-ol;5,7-dichloroquinolin-8-ol
    2.1.2 InChI
    InChI=1S/C9H5Cl2NO.2C9H6ClNO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8;10-7-3-4-8(12)9-6(7)2-1-5-11-9;10-7-4-3-6-2-1-5-11-8(6)9(7)12/h1-4,13H;2*1-5,12H
    2.1.3 InChI Key
    XCQBENAYFZFNAR-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC2=C(C(=C(C=C2)Cl)O)N=C1.C1=CC2=C(C=CC(=C2N=C1)O)Cl.C1=CC2=C(C(=C(C=C2Cl)Cl)O)N=C1
    2.2 Synonyms
    2.2.1 MeSH Synonyms

    1. Chlorhydroxyquinoline

    2. Halquinol

    2.2.2 Depositor-Supplied Synonyms

    1. Sq 16,401

    2. 5-chloroquinolin-8-ol;7-chloroquinolin-8-ol;5,7-dichloroquinolin-8-ol

    3. Tarquinor

    4. 8-quinolinol, 5,7-dichloro-, Mixt. With 5-chloro-8-quinolinol And 7-chloro-8-quinolinol

    5. Halquinols [usan]

    6. Unii-z7z4bx535u

    7. Z7z4bx535u

    8. Chembl3833358

    9. Dtxsid90230490

    10. Mfcd28978222

    11. 5-chloroquinolin-8-ol; 7-chloroquinolin-8-ol; 5,7-dichloroquinolin-8-ol

    12. 5,7-dichloro-8-quinolinol Mixt. With 5-chloro-8-quinolinol And 7-chloro-8-quinolinol

    13. 5,7-dichloro-8-quinolinol, 5-chloro-8-quinolinol, And 7-chloro-8-quinolinol In Proportions Resulting Naturally From Chlorination Of 8-quinolinol

    14. Sq-16401

    15. Sy272205

    16. So 16,401

    17. Ft-0626854

    18. A839963

    19. 5,7-dichloro-8-quinolino & 5-chloro-8-quinolino & 7-chloro-8-quinnolinol

    20. 5-chloro-8-quinolinol; 7-chloro-8-quinolinol; 5,7-dichloro-8-quinolinol

    21. 5,7-bis(chloranyl)quinolin-8-ol; 5-chloranylquinolin-8-ol; 7-chloranylquinolin-8-ol

    2.3 Create Date
    2005-08-01
    3 Chemical and Physical Properties
    Molecular Weight 573.2 g/mol
    Molecular Formula C27H17Cl4N3O3
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count6
    Rotatable Bond Count0
    Exact Mass572.999452 g/mol
    Monoisotopic Mass571.002402 g/mol
    Topological Polar Surface Area99.4 Ų
    Heavy Atom Count37
    Formal Charge0
    Complexity520
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count3
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