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    Technical details about 1,3-Dioxan-5-Ol, learn more about the structure, uses, toxicity, action, side effects and more

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    1,3-Dioxan-5-Ol

    PRICE INFORMATION

    ANALYTICAL SOLUTION(s)

    PharmaCompass

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    2D Structure
    1. Also known as: 4740-78-7, 5-hydroxy-1,3-dioxane, 86687-05-0, 1,3-formalglycerol, Glycerol formal, alpha,alpha', M-dioxan-5-ol
    Molecular Formula
    C4H8O3
    Molecular Weight
    104.10  g/mol
    InChI Key
    VCKSNYNNVSOWEE-UHFFFAOYSA-N
    FDA UNII
    F6UP32GBII
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1,3-dioxan-5-ol
    2.1.2 InChI
    InChI=1S/C4H8O3/c5-4-1-6-3-7-2-4/h4-5H,1-3H2
    2.1.3 InChI Key
    VCKSNYNNVSOWEE-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1C(COCO1)O
    2.2 Other Identifiers
    2.2.1 UNII
    F6UP32GBII
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 4740-78-7

    2. 5-hydroxy-1,3-dioxane

    3. 86687-05-0

    4. 1,3-formalglycerol

    5. Glycerol Formal, Alpha,alpha'

    6. M-dioxan-5-ol

    7. F6up32gbii

    8. Mfcd00014645

    9. Glycerol Formal (mixture Of 5-hydroxy-1,3-dioxane And 4-hydroxymethyl-1,3-dioxolane)

    10. Unii-f6up32gbii

    11. Einecs 225-248-9

    12. 5-hydroxy-m-dioxane

    13. Glycerol Formal (=1,3-dioxan-5-ol)

    14. Alpha,.alpha'glycerol Formal

    15. Schembl337298

    16. Dtxsid20197128

    17. Zinc4262027

    18. Bbl011466

    19. Stl146578

    20. Akos005720978

    21. Ds-18121

    22. Glycerol Formal, .alpha.,.alpha'

    23. Sy039164

    24. Ft-0622101

    25. Ft-0699554

    26. G0391

    27. 687d050

    28. Q27277728

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 104.10 g/mol
    Molecular Formula C4H8O3
    XLogP3-0.8
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count0
    Exact Mass104.047344113 g/mol
    Monoisotopic Mass104.047344113 g/mol
    Topological Polar Surface Area38.7 Ų
    Heavy Atom Count7
    Formal Charge0
    Complexity48.9
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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