menu
    • menu

    CAS 52187-19-6 manufacturers and suppliers on PharmaCompass

    LGM Pharma accelerates & optimizes the new product pathway from early development through commercialization.

    Virtual Booth

    Contact Supplier

    Munit offers scalable GMP micronization and particle size engineering to enhance drug solubility, bioavailability, and performance.

    Virtual Booth

    Contact Supplier

    pharmacompass-1-m-2025-11-03

    Virtual Booth

    Contact Supplier

    Mission CDMO team brings reliability, resourcefulness, & responsiveness in executing your development project.

    Virtual Booth

    Contact Supplier

    Jai Radhe Sales is your partner for all your sourcing needs.

    Virtual Booth

    Contact Supplier

    pharmacompass-2-m-2025-11-03

    Virtual Booth

    Contact Supplier

    BUILDING BLOCK

    PharmaCompass

    Chemistry

    Click the arrow to open the dropdown
    read-moreClick the button for full data set
    read-moreClick the button for full data set
    Also known as: Zinc5762611, (3as)-3aalpha,4,9,9aalpha-tetrahydro-2,2-dimethylnaphtho[2,3-d]-1,3-dioxol-5-ol
    Molecular Formula
    C13H16O3
    Molecular Weight
    220.26  g/mol
    InChI Key
    VHQZRMCDYDICCK-NEPJUHHUSA-N
    CAS 52187-19-6
    1 2D Structure

    CAS 52187-19-6

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (3aS,9aR)-2,2-dimethyl-3a,4,9,9a-tetrahydrobenzo[f][1,3]benzodioxol-5-ol
    2.1.2 InChI
    InChI=1S/C13H16O3/c1-13(2)15-11-6-8-4-3-5-10(14)9(8)7-12(11)16-13/h3-5,11-12,14H,6-7H2,1-2H3/t11-,12+/m1/s1
    2.1.3 InChI Key
    VHQZRMCDYDICCK-NEPJUHHUSA-N
    2.1.4 Canonical SMILES
    CC1(OC2CC3=C(CC2O1)C(=CC=C3)O)C
    2.1.5 Isomeric SMILES
    CC1(O[C@@H]2CC3=C(C[C@@H]2O1)C(=CC=C3)O)C
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. Zinc5762611

    2. (3as)-3aalpha,4,9,9aalpha-tetrahydro-2,2-dimethylnaphtho[2,3-d]-1,3-dioxol-5-ol

    2.3 Create Date
    2007-02-07
    3 Chemical and Physical Properties
    Molecular Weight 220.26 g/mol
    Molecular Formula C13H16O3
    XLogP32.2
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count0
    Exact Mass220.109944368 g/mol
    Monoisotopic Mass220.109944368 g/mol
    Topological Polar Surface Area38.7 Ų
    Heavy Atom Count16
    Formal Charge0
    Complexity276
    Isotope Atom Count0
    Defined Atom Stereocenter Count2
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1

    BUILDING BLOCK

    Upload your portfolio for free, ask us

    END USE APIs

    read-more
    read-more
    Ask Us for Pharmaceutical Supplier and Partner
    Ask Us, Find A Supplier / Partner
    No Commissions, No Strings Attached, Get Connected for FREE

    What are you looking for?

    How can we help you?

    The request can't be empty

    Please read our Privacy Policy carefully

    You must agree to the privacy policy

    The name can't be empty
    The company can't be empty.
    The email can't be empty Please enter a valid email.
    The mobile can't be empty

    Market Place

    Market Place

    PharmaCompass

    Home

    Market Place

    Menu

    Post Enquiry

    Post Enquiry

    Market Place

    Market Place

    Search