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    Histidine Dihydrochloride

    ACTIVE PHARMA INGREDIENTS

    MARKET PLACE

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 6459-59-2, 2-amino-3-(1h-imidazol-4-yl)propanoic acid hydrochloride, Dl-histidine hydrochloride, Dl-histidine monohcl, 2-amino-3-(1h-imidazol-5-yl)propanoic acid;hydrochloride, L-hisidine monohydrocholoride
    Molecular Formula
    C6H10ClN3O2
    Molecular Weight
    191.61  g/mol
    InChI Key
    QZNNVYOVQUKYSC-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-amino-3-(1H-imidazol-5-yl)propanoic acid;hydrochloride
    2.1.2 InChI
    InChI=1S/C6H9N3O2.ClH/c7-5(6(10)11)1-4-2-8-3-9-4;/h2-3,5H,1,7H2,(H,8,9)(H,10,11);1H
    2.1.3 InChI Key
    QZNNVYOVQUKYSC-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=C(NC=N1)CC(C(=O)O)N.Cl
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 6459-59-2

    2. 2-amino-3-(1h-imidazol-4-yl)propanoic Acid Hydrochloride

    3. Dl-histidine Hydrochloride

    4. Dl-histidine Monohcl

    5. 2-amino-3-(1h-imidazol-5-yl)propanoic Acid;hydrochloride

    6. L-hisidine Monohydrocholoride

    7. L-(+)-histidine Monohydrochloride

    8. H-his-oh.hcl.h2o

    9. Dl-histidine, Hydrochloride

    10. L-histidine, Monohydrochloride

    11. L-histidine Monohydrochloride

    12. (-)-histidine Monohydrochloride; Histidine Hydrochloride; Histidine Monohydrochloride; L-histidine Hydrochloride

    13. Nsc27422

    14. D-histidine, Hydrochloride

    15. (-)-histidine Monohydrochloride

    16. 2-amino-3-(1h-imidazol-5-yl)propanoic Acid Hydrochloride

    17. Dl-histidine, Monohydrochloride

    18. Nsc-46706

    19. Histidine Monohydrochloride, L-(+)-

    20. Nsc-257867

    21. Dl-histidinemonohydrochloride

    22. D-histidinehcl

    23. Histidine,(l)

    24. (--)-histidinmonohydrochlorid

    25. Schembl139654

    26. Dtxsid401014452

    27. Nsc46706

    28. Mfcd00064555

    29. Nsc-27422

    30. Nsc206275

    31. Nsc257867

    32. Akos015847815

    33. Akos016367771

    34. Fd21742

    35. Nsc-206275

    36. As-49192

    37. Dl-histidine Monohcl (h-dl-his-oh.hcl)

    38. Db-054686

    39. Db-054695

    40. Cs-0368312

    41. Ft-0627841

    42. Ft-0636156

    43. Ft-0689540

    44. En300-74227

    45. A834822

    46. Benzo[d]isoxazol-3-yl-methanesulfonylchloride

    2.3 Create Date
    2007-02-09
    3 Chemical and Physical Properties
    Molecular Weight 191.61 g/mol
    Molecular Formula C6H10ClN3O2
    Hydrogen Bond Donor Count4
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count3
    Exact Mass191.0461543 g/mol
    Monoisotopic Mass191.0461543 g/mol
    Topological Polar Surface Area92 Ų
    Heavy Atom Count12
    Formal Charge0
    Complexity151
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2