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    D valine

    ACTIVE PHARMA INGREDIENTS

    PharmaCompass
    $ API Ref.Price (USD/KG) : 99Xls

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    2D Structure
    Also known as: 640-68-6, H-d-val-oh, (r)-valine, Valine, d-, (2r)-2-amino-3-methylbutanoic acid, D-2-amino-3-methylbutanoic acid
    Molecular Formula
    C5H11NO2
    Molecular Weight
    117.15  g/mol
    InChI Key
    KZSNJWFQEVHDMF-SCSAIBSYSA-N
    FDA UNII
    Y14I1443UR
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (2R)-2-amino-3-methylbutanoic acid
    2.1.2 InChI
    InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m1/s1
    2.1.3 InChI Key
    KZSNJWFQEVHDMF-SCSAIBSYSA-N
    2.1.4 Canonical SMILES
    CC(C)C(C(=O)O)N
    2.1.5 Isomeric SMILES
    CC(C)[C@H](C(=O)O)N
    2.2 Other Identifiers
    2.2.1 UNII
    Y14I1443UR
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 640-68-6

    2. H-d-val-oh

    3. (r)-valine

    4. Valine, D-

    5. (2r)-2-amino-3-methylbutanoic Acid

    6. D-2-amino-3-methylbutanoic Acid

    7. D-valin

    8. (r)-2-amino-3-methylbutanoic Acid

    9. Nsc 20654

    10. D-val

    11. D-2-aminoisovaleric Acid

    12. Chembl1232398

    13. Chebi:27477

    14. Y14i1443ur

    15. (r)-2-amino-3-methylbutyric Acid

    16. Ncgc00159470-02

    17. (2r)-2-ammonio-3-methylbutanoate

    18. Dva

    19. Mfcd00064219

    20. Einecs 211-368-9

    21. 2-amino-3-methyl-butyric Acid

    22. Unii-y14i1443ur

    23. D Valine

    24. Nsc-20654

    25. R-valine

    26. D-valine, >=98%

    27. Dsstox_cid_26064

    28. Dsstox_rid_81315

    29. D-(-)-valine

    30. Dsstox_gsid_46064

    31. Schembl43678

    32. (r)-alpha-aminoisovaleric Acid

    33. Valine, (-)-

    34. Dtxsid0046064

    35. Hy-n0717a

    36. Zinc896156

    37. Act04818

    38. Bcp10545

    39. Tox21_111694

    40. Ac7511

    41. Bdbm50357216

    42. Akos006240045

    43. Akos015841471

    44. Am82362

    45. Ac-24061

    46. As-14130

    47. Cas-640-68-6

    48. D-valine, Vetec(tm) Reagent Grade, 98%

    49. Cs-0010218

    50. V0012

    51. En300-54608

    52. 40v686

    53. C06417

    54. D-valine, Suitable For Cell Culture, Bioreagent

    55. A847288

    56. J-300291

    57. Q27103152

    58. 9040e22a-ffb5-4a57-a5dc-9f7b09e64f07

    59. F1905-7038

    2.4 Create Date
    2004-09-16
    3 Chemical and Physical Properties
    Molecular Weight 117.15 g/mol
    Molecular Formula C5H11NO2
    XLogP3-2.3
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count2
    Exact Mass117.078978594 g/mol
    Monoisotopic Mass117.078978594 g/mol
    Topological Polar Surface Area63.3 Ų
    Heavy Atom Count8
    Formal Charge0
    Complexity90.4
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1