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    Thiamine Mononitrate

    ACTIVE PHARMA INGREDIENTS

    FINISHED DOSAGE FORMULATIONS

    GLOBAL SALES INFORMATION

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    PharmaCompass
    $ API Ref.Price (USD/KG) : 25Xls

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    2D Structure
    Also known as: 532-43-4, Thiamine mononitrate, Vitamin b1 nitrate, Vitamin b1 mononitrate, Aneurine mononitrate, Betabion mononitrate
    Molecular Formula
    C12H17N5O4S
    Molecular Weight
    327.36  g/mol
    InChI Key
    UIERGBJEBXXIGO-UHFFFAOYSA-N
    FDA UNII
    8K0I04919X
    3-((4-Amino-2-methyl-5-pyrimidinyl)methyl)-5-(2- hydroxyethyl)-4-methylthiazolium chloride.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;nitrate
    2.1.2 InChI
    InChI=1S/C12H17N4OS.NO3/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13;2-1(3)4/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15);/q+1;-1
    2.1.3 InChI Key
    UIERGBJEBXXIGO-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.[N+](=O)([O-])[O-]
    2.2 Other Identifiers
    2.2.1 UNII
    8K0I04919X
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Aneurin

    2. Mononitrate, Thiamine

    3. Thiamin

    4. Thiamine

    5. Thiamine Mononitrate

    6. Vitamin B 1

    7. Vitamin B1

    2.3.2 Depositor-Supplied Synonyms

    1. 532-43-4

    2. Thiamine Mononitrate

    3. Vitamin B1 Nitrate

    4. Vitamin B1 Mononitrate

    5. Aneurine Mononitrate

    6. Betabion Mononitrate

    7. Thiamine Nitrate (salt)

    8. Thiamin Mononitrate

    9. Thiamine Mononitrate [usp]

    10. Vitamin B1 (as Thiamine Nitrate)

    11. 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;nitrate

    12. 8k0i04919x

    13. Thiazolium, 3-((4-amino-2-methyl-5-pyrimidinyl)methyl)-5-(2-hydroxyethyl)-4-methyl-, Nitrate (salt)

    14. Aneurine Nitrate

    15. Thiamine Mononitrate (usp)

    16. 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium Nitrate

    17. Thiaminenitrate

    18. Vitamin B(sub 1) Nitrate

    19. Mononitrato De Tiamina

    20. Einecs 208-537-4

    21. Thiamin Nitrate

    22. Unii-8k0i04919x

    23. Thiamini Mononitras

    24. Vitanon (tn)

    25. Mfcd00036330

    26. Thiamine Nitrate, 95%

    27. Thiamine Mononitrate,(s)

    28. Thiamine Nitrate (jp17)

    29. 3-((4-amino-2-methyl-5-pyrimidinyl)methyl)-5-(2-hydroxyethyl)-4-methylthiazolium Nitrate

    30. 3-(4-amino-2-methylpyrimidyl-5-methyl)-4-methyl-5,beta-hydroxyethylthiazolium Nitrate

    31. Dsstox_cid_18762

    32. Dsstox_rid_79391

    33. Dsstox_gsid_38762

    34. Schembl60971

    35. Thiamine Nitrate, Aldrichcpr

    36. Thiamine Nitrate [jan]

    37. Thiamine Nitrate [inci]

    38. Chembl2104496

    39. Dtxsid4038762

    40. Thiamine Mononitrate [mi]

    41. Thiamine Nitrate [mart.]

    42. Thiamine Mononitrate [fcc]

    43. Hy-b2223

    44. Thiamine Mononitrate [vandf]

    45. Tox21_302321

    46. Thiamine Mononitrate [who-dd]

    47. Thiamine Mononitrate [who-ip]

    48. Akos015918391

    49. Akos015961239

    50. Thiamine Nitrate [ep Impurity]

    51. Cs-7673

    52. Thiamine Mononitrate, >=98% (hplc)

    53. Thiamine Nitrate [ep Monograph]

    54. Ncgc00255700-01

    55. 3-((4-amino-2-methyl-5-pyrimidinyl)methyl)-5-(2-hydroxyethyl)-4-m-ethylthiazolium Nitrate (salt)

    56. Ac-13450

    57. As-15189

    58. Cas-532-43-4

    59. Thiamine Nitrate (salt) [who-ip]

    60. Thiazolium, 3-((4-amino-2-methyl-5-pyrimidinyl)methyl)-5-(2-hydroxyethyl)-4-m-ethyl-, Nitrate (salt)

    61. Thiazolium,3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-5-(2-hydroxyethyl)-4-methyl-,nitrate (salt)

    62. Thiamini Mononitras [who-ip Latin]

    63. Thiamine Mononitrate [usp Monograph]

    64. Ft-0657793

    65. T0182

    66. 3-((4-amino-2-methylpyrimidin-5-yl)methyl)

    67. D03277

    68. E78994

    69. A829473

    70. Q7783874

    71. Thiamine Mononitrate 10 Microg/ml In Acetonitrile:water

    72. Thiamine Mononitrate, British Pharmacopoeia (bp) Reference Standard

    73. Thiamine Nitrate, European Pharmacopoeia (ep) Reference Standard

    74. Thiamine Nitrate, Pharmaceutical Secondary Standard; Certified Reference Material

    75. 3-((4-amino-2-methylpyrimidin-5-yl)methyl)-5-(2-hydroxyethyl)-4-methylthiazol-3-ium Nitrate

    76. Thiazolium, 3-((4-amino-2-methyl-5-pyrimidinyl)methyl)-5-(2-hydroxyethyl)-4-methyl-, Nitrate (1:1)

    77. Thiazolium, 3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-5-(2hydroxyethyl)-4-m-ethyl-, Nitrate (salt)

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 327.36 g/mol
    Molecular Formula C12H17N5O4S
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count8
    Rotatable Bond Count4
    Exact Mass327.10012521 g/mol
    Monoisotopic Mass327.10012521 g/mol
    Topological Polar Surface Area167 Ų
    Heavy Atom Count22
    Formal Charge0
    Complexity287
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Vitamin B Complex

    A group of water-soluble vitamins, some of which are COENZYMES. (See all compounds classified as Vitamin B Complex.)