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    CAS 598-50-5

    BUILDING BLOCK

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 1-methylurea, N-methylurea, 598-50-5, Monomethylurea, Urea, methyl-, Methyl urea
    Molecular Formula
    C2H6N2O
    Molecular Weight
    74.08  g/mol
    InChI Key
    XGEGHDBEHXKFPX-UHFFFAOYSA-N
    FDA UNII
    VZ89YBW3P8
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    methylurea
    2.1.2 InChI
    InChI=1S/C2H6N2O/c1-4-2(3)5/h1H3,(H3,3,4,5)
    2.1.3 InChI Key
    XGEGHDBEHXKFPX-UHFFFAOYSA-N
    2.2 Other Identifiers
    2.2.1 UNII
    VZ89YBW3P8
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Monomethylurea

    2.3.2 Depositor-Supplied Synonyms

    1. 1-methylurea

    2. N-methylurea

    3. 598-50-5

    4. Monomethylurea

    5. Urea, Methyl-

    6. Methyl Urea

    7. Urea, N-methyl-

    8. Methylmocovina

    9. Methylharnstoff

    10. Vz89ybw3p8

    11. Dtxsid5060510

    12. Refchem:818755

    13. Dtxcid4042703

    14. 209-935-0

    15. N-methyl Urea

    16. Mfcd00007950

    17. 1-methylurea;1-methylurea

    18. Methylharnstoff [german]

    19. Methylmocovina [czech]

    20. Ccris 9137

    21. Einecs 209-935-0

    22. Methylisourea

    23. Methyl-urea

    24. Ai3-15088

    25. 3-methyl-urea

    26. N-methylurea, 97%

    27. Ch3nhconh2

    28. Bmse000738

    29. Unii-vz89ybw3p8

    30. Ec 209-935-0

    31. Schembl10181

    32. Schembl31472

    33. Schembl55198

    34. Schembl425945

    35. Gtpl4662

    36. Schembl2887632

    37. Schembl4593047

    38. Schembl7124696

    39. Schembl30707875

    40. Chebi:44383

    41. Str01326

    42. Ac8061

    43. Bbl013131

    44. Stk400004

    45. Akos000120665

    46. Cs-w016687

    47. Sy018863

    48. Db-053475

    49. M0455

    50. Ns00006191

    51. En300-17436

    52. N-methylurea, Vetec(tm) Reagent Grade, 97%

    53. F227727

    54. L000900

    55. Q5476523

    56. Z56932989

    57. F0001-1568

    58. Inchi=1/c2h6n2o/c1-4-2(3)5/h1h3,(h3,3,4,5

    59. 608090-15-9

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 74.08 g/mol
    Molecular Formula C2H6N2O
    XLogP3-1.4
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count0
    Exact Mass Da
    Monoisotopic Mass Da
    Topological Polar Surface Area55.1
    Heavy Atom Count5
    Formal Charge0
    Complexity42.9
    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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