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    CAS 793669-26-8 manufacturers and suppliers on PharmaCompass

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

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

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

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

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    BUILDING BLOCK

    PharmaCompass

    Chemistry

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    Also known as:
    Molecular Formula
    C22H22F2O4
    Molecular Weight
    388.4  g/mol
    InChI Key
    KRZVGYRXIAATFD-LXXSSVHESA-N
    CAS 793669-26-8
    1 2D Structure

    CAS 793669-26-8

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene;(2R)-6-fluoro-2-[(2S)-oxiran-2-yl]-3,4-dihydro-2H-chromene
    2.1.2 InChI
    InChI=1S/2C11H11FO2/c2*12-8-2-4-9-7(5-8)1-3-10(14-9)11-6-13-11/h2*2,4-5,10-11H,1,3,6H2/t2*10-,11+/m10/s1
    2.1.3 InChI Key
    KRZVGYRXIAATFD-LXXSSVHESA-N
    2.1.4 Canonical SMILES
    C1CC2=C(C=CC(=C2)F)OC1C3CO3.C1CC2=C(C=CC(=C2)F)OC1C3CO3
    2.1.5 Isomeric SMILES
    C1CC2=C(C=CC(=C2)F)O[C@H]1[C@@H]3CO3.C1CC2=C(C=CC(=C2)F)O[C@@H]1[C@H]3CO3
    2.2 Create Date
    2018-05-25
    3 Chemical and Physical Properties
    Molecular Weight 388.4 g/mol
    Molecular Formula C22H22F2O4
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count6
    Rotatable Bond Count2
    Exact Mass388.14861550 g/mol
    Monoisotopic Mass388.14861550 g/mol
    Topological Polar Surface Area43.5 Ų
    Heavy Atom Count28
    Formal Charge0
    Complexity221
    Isotope Atom Count0
    Defined Atom Stereocenter Count4
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2

    BUILDING BLOCK

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