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    Technical details about CAS 504-08-5, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 504-08-5

    BUILDING BLOCK

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    2D Structure
    Also known as: 504-08-5, 2,4-diamino-1,3,5-triazine, Formoguanamine, Guanamine, 4,6-diamino-s-triazine, Diamino-s-triazine
    Molecular Formula
    C3H5N5
    Molecular Weight
    111.11  g/mol
    InChI Key
    VZXTWGWHSMCWGA-UHFFFAOYSA-N
    FDA UNII
    A6GN3JB7H4
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1,3,5-triazine-2,4-diamine
    2.1.2 InChI
    InChI=1S/C3H5N5/c4-2-6-1-7-3(5)8-2/h1H,(H4,4,5,6,7,8)
    2.1.3 InChI Key
    VZXTWGWHSMCWGA-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=NC(=NC(=N1)N)N
    2.2 Other Identifiers
    2.2.1 UNII
    A6GN3JB7H4
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 2,4-diamino-s-triazine

    2. Formoguanamine

    2.3.2 Depositor-Supplied Synonyms

    1. 504-08-5

    2. 2,4-diamino-1,3,5-triazine

    3. Formoguanamine

    4. Guanamine

    5. 4,6-diamino-s-triazine

    6. Diamino-s-triazine

    7. 2,6-diamino-s-triazine

    8. 2,4-diamino-s-triazine

    9. S-triazine, 2,4-diamino-

    10. Nsc 251

    11. A6gn3jb7h4

    12. Nsc-251

    13. Einecs 207-983-7

    14. S-triazine,4-diamino-

    15. Ai3-51263

    16. Unii-a6gn3jb7h4

    17. Schembl65511

    18. Yswg323

    19. 1,5-triazine-2,4-diamine

    20. Fmoc-(3-aminophenyl)aceticacid

    21. Nsc251

    22. 2,4-diaminotriazine (related)

    23. Dtxsid7074292

    24. Chebi:38071

    25. [1,3,5]triazine-2,4-diamine

    26. Albb-014718

    27. Zinc1445475

    28. Mfcd00014598

    29. Stk256616

    30. Akos005174532

    31. Sb73700

    32. As-48301

    33. Cs-0110380

    34. D2227

    35. Ft-0609961

    36. D-2227

    37. F30229

    38. A871573

    39. Q27117366

    40. Zzs

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 111.11 g/mol
    Molecular Formula C3H5N5
    XLogP3-0.7
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count0
    Exact Mass111.05449518 g/mol
    Monoisotopic Mass111.05449518 g/mol
    Topological Polar Surface Area90.7 Ų
    Heavy Atom Count8
    Formal Charge0
    Complexity66.1
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1