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Polpharma European CDMO Partner & API Manufacturer since 1951 Polpharma European CDMO Partner & API Manufacturer since 1951

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    Technical details about 2-Methyl-7H-purin-6-ol, learn more about the structure, uses, toxicity, action, side effects and more

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    2-Methyl-7H-purin-6-ol

    PharmaCompass

    Bora Pharmaceuticals- Making success more certain.

    AbbVie CDMO has been working with global companies to develop, manufacture & scale biopharmaceutical products.

    2D Structure
    1. Also known as: 5167-18-0, 2-methyl-1h-purin-6(9h)-one, 2-methyl-3h-purin-6(7h)-one, 1,7-dihydro-2-methyl-6-purinone, 2-methyl-3,7-dihydropurin-6-one, 6h-purin-6-one, 1,7-dihydro-2-methyl-
    Molecular Formula
    C6H6N4O
    Molecular Weight
    150.14  g/mol
    InChI Key
    JXLWCABYHOMQHE-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-methyl-1,7-dihydropurin-6-one
    2.1.2 InChI
    InChI=1S/C6H6N4O/c1-3-9-5-4(6(11)10-3)7-2-8-5/h2H,1H3,(H2,7,8,9,10,11)
    2.1.3 InChI Key
    JXLWCABYHOMQHE-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC1=NC2=C(C(=O)N1)NC=N2
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 5167-18-0

    2. 2-methyl-1h-purin-6(9h)-one

    3. 2-methyl-3h-purin-6(7h)-one

    4. 1,7-dihydro-2-methyl-6-purinone

    5. 2-methyl-3,7-dihydropurin-6-one

    6. 6h-purin-6-one, 1,7-dihydro-2-methyl-

    7. 1,7-dihydro-2-methyl-6h-purin-6-one

    8. 2-methylhypoxanthine

    9. 2-methyl-1h-purin-6(7h)-one

    10. 2-methylhypoxanthin

    11. 2-methyl-1,9-dihydro-6h-purin-6-one

    12. Schembl1898182

    13. Schembl8278860

    14. Dtxsid80355762

    15. Amy11471

    16. Fd7251

    17. Mfcd02685601

    18. Mfcd03428508

    19. Zinc14982924

    20. Akos006348855

    21. Akos015856512

    22. Akos022717463

    23. Akos025146850

    24. 2-methyl-3,7-dihydro-6h-purin-6-one

    25. 2-methyl-6,7-dihydro-1h-purin-6-one

    26. 2-methyl-6,9-dihydro-1h-purin-6-one

    27. Ac-26670

    28. Cs-11445

    29. Sy021393

    30. 2-methyl-1,7-dihydropurin-6-one

    31. Db-049852

    32. Cs-0045896

    33. Ft-0612993

    34. 167m180

    35. A828723

    36. Ac-907/25004538

    2.3 Create Date
    2019-01-15
    3 Chemical and Physical Properties
    Molecular Weight 150.14 g/mol
    Molecular Formula C6H6N4O
    XLogP3-0.5
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count0
    Exact Mass150.05416083 g/mol
    Monoisotopic Mass150.05416083 g/mol
    Topological Polar Surface Area70.1 Ų
    Heavy Atom Count11
    Formal Charge0
    Complexity225
    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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