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    CAS 10310-21-1

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    CAS 10310-21-1
    Also known as: 10310-21-1, 6-chloroguanine, 6-chloro-7h-purin-2-amine, 6-chloro-9h-purin-2-amine, 6-chloro-2-aminopurine, 2-amino-6-chlorpurine
    Molecular Formula
    C5H4ClN5
    Molecular Weight
    169.57  g/mol
    InChI Key
    RYYIULNRIVUMTQ-UHFFFAOYSA-N
    FDA UNII
    83V03P835E
    1 2D Structure

    CAS 10310-21-1

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    6-chloro-7H-purin-2-amine
    2.1.2 InChI
    InChI=1S/C5H4ClN5/c6-3-2-4(9-1-8-2)11-5(7)10-3/h1H,(H3,7,8,9,10,11)
    2.1.3 InChI Key
    RYYIULNRIVUMTQ-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=NC2=C(N1)C(=NC(=N2)N)Cl
    2.2 Other Identifiers
    2.2.1 UNII
    83V03P835E
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 10310-21-1

    2. 6-chloroguanine

    3. 6-chloro-7h-purin-2-amine

    4. 6-chloro-9h-purin-2-amine

    5. 6-chloro-2-aminopurine

    6. 2-amino-6-chlorpurine

    7. Purine, 2-amino-6-chloro-

    8. 2-amino-6-chloro-purin

    9. 1h-purin-2-amine, 6-chloro-

    10. 6-chloro-7h-purin-2-ylamine

    11. 9h-purin-2-amine, 6-chloro-

    12. 2-amino-6-chloro-purine

    13. 6-chloro-1h-purin-2-amine

    14. Mfcd00075252

    15. 2-amino-6-chloro-9h-purine

    16. 2-amino-6-chloropurin-9-yl

    17. 6-chloro-2-purinamine

    18. 2-amino-6-chloro Purine

    19. 6-chloro-2-amino-purine

    20. 6-chloro-9h-purin-2-ylamine

    21. Famciclovir Related Compound F

    22. Chembl226396

    23. Chebi:72345

    24. Nsc-29570

    25. 83v03p835e

    26. 133762-81-9

    27. Einecs 233-686-7

    28. Nsc 29570

    29. Ccris 3906

    30. Unii-83v03p835e

    31. 6gu

    32. Aurora Ka-689

    33. 2-amino-6chloropurine

    34. 6-cl-purine (1)

    35. Bmse000984

    36. Schembl6711

    37. Mls006011426

    38. 6-chloro-1h-purine-2-amine

    39. 2-amino-6-chloropurine, 97%

    40. Dtxsid9074432

    41. 6-chloro-9h-purin-2-amine #

    42. Am677

    43. 2-amino-6-chloropurine, >=99%

    44. Act02228

    45. Albb-023676

    46. Bcp27028

    47. Cs-d1374

    48. Nsc29570

    49. Zinc6523923

    50. Ab2611

    51. Bbl010748

    52. Bdbm50208877

    53. Stk801756

    54. Akos000266285

    55. Akos005622720

    56. Akos028108866

    57. Ac-5457

    58. As-2051

    59. 6-chloro-2-purinamine, 6-chloroguanine

    60. Smr002529527

    61. Sy001781

    62. 6-chloro-9h-purin-2-yl-2-amine

    63. Db-005179

    64. Ft-0600035

    65. C-4110

    66. Famciclovir Related Compound F [usp-rs]

    67. 310a211

    68. Sr-01000944797

    69. Q-200234

    70. Sr-01000944797-1

    71. Q27139921

    72. 9-n-butyl-1,2,3,4,5,6,7,8-octahydroacridin-4-ol

    73. F0001-0084

    74. Z2723701924

    75. Famciclovir Related Compound F, United States Pharmacopeia (usp) Reference Standard

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 169.57 g/mol
    Molecular Formula C5H4ClN5
    XLogP30.4
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count0
    Exact Mass169.0155228 g/mol
    Monoisotopic Mass169.0155228 g/mol
    Topological Polar Surface Area80.5 Ų
    Heavy Atom Count11
    Formal Charge0
    Complexity154
    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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