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    Chemistry

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    Also known as: 645-93-2, 6-amino-1,3,5-triazine-2,4-diol, 6-amino-s-triazine-2,4-diol, 6-amino-1,3,5-triazine-2,4(1h,3h)-dione, 1,3,5-triazine-2,4(1h,3h)-dione, 6-amino-, 6-amino-1h-1,3,5-triazine-2,4-dione
    Molecular Formula
    C3H4N4O2
    Molecular Weight
    128.09  g/mol
    InChI Key
    YSKUZVBSHIWEFK-UHFFFAOYSA-N
    FDA UNII
    J604QC4098
    Ammelide
    1 2D Structure

    Ammelide

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    6-amino-1H-1,3,5-triazine-2,4-dione
    2.1.2 InChI
    InChI=1S/C3H4N4O2/c4-1-5-2(8)7-3(9)6-1/h(H4,4,5,6,7,8,9)
    2.1.3 InChI Key
    YSKUZVBSHIWEFK-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1(=NC(=O)NC(=O)N1)N
    2.2 Other Identifiers
    2.2.1 UNII
    J604QC4098
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 6-amino-1,3,5-triazine-2,4(1h,3h)-dione

    2. Ammelide Copper

    2.3.2 Depositor-Supplied Synonyms

    1. 645-93-2

    2. 6-amino-1,3,5-triazine-2,4-diol

    3. 6-amino-s-triazine-2,4-diol

    4. 6-amino-1,3,5-triazine-2,4(1h,3h)-dione

    5. 1,3,5-triazine-2,4(1h,3h)-dione, 6-amino-

    6. 6-amino-1h-1,3,5-triazine-2,4-dione

    7. 2,4-dihydroxy-6-amino-1,3,5-triazine

    8. Dtxsid10214757

    9. Nsc-8146

    10. Ammedlide

    11. J604qc4098

    12. 167613-80-1

    13. Ammelide-13c3

    14. 1,3,5-triazine-2,4-diol,6-amino-(9ci)

    15. Melanuric Acid

    16. Unii-j604qc4098

    17. Nsc 8146

    18. Einecs 211-456-7

    19. Ammelide; 98%

    20. Cyanuric Acid Monoamide

    21. Ai3-61038

    22. Schembl36691

    23. Ammelide, Analytical Standard

    24. Chebi:28134

    25. Nsc8146

    26. Terbuthylazine-tp Mt24 (lm1)

    27. Mfcd00049046

    28. Stl186172

    29. Zinc13529033

    30. Akos006222979

    31. Akos022175465

    32. Sb73399

    33. Cid 5281299

    34. As-60764

    35. 6-azanyl-1h-1,3,5-triazine-2,4-dione

    36. Db-054694

    37. A0645

    38. Ft-0622302

    39. C08734

    40. T71177

    41. 6-amino-2,4-dihydroxy-1,3,5-triazine

    42. A834821

    43. Q4747226

    44. Dihydro-6-imino-1,3,5-triazine-2,4(1h,3h)-dione

    45. 6-amino-1,3,5-triazine-2,4(1h,3h)-dione, Aldrichcpr

    2.4 Create Date
    2004-09-16
    3 Chemical and Physical Properties
    Molecular Weight 128.09 g/mol
    Molecular Formula C3H4N4O2
    XLogP3-1.5
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count0
    Exact Mass128.03342538 g/mol
    Monoisotopic Mass128.03342538 g/mol
    Topological Polar Surface Area96.6 Ų
    Heavy Atom Count9
    Formal Charge0
    Complexity196
    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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