Please Wait
Applying Filters...
menu
    • menu
    Granules India Limited has high volume world-class facilities for APIs, PFIs, & FDFs, serving customers in over 80 countries.

    Virtual Booth

    Contact Supplier

    Jai Radhe Sales is your partner for all your sourcing needs.

    Virtual Booth

    Contact Supplier

    xyz-pharma-m-2024-10-07

    Virtual Booth

    Contact Supplier

    Egis is a Hungarian generic pharma company with 110 years history. Our activities incorporate all areas of the pharma value chain.

    Virtual Booth

    Contact Supplier

    Biophore is a research-driven global pharmaceutical company focused on niche APIs for the generic industry.

    Virtual Booth

    Contact Supplier

    xyz-pharma-m-2024-10-07

    Virtual Booth

    Contact Supplier

    Menu

    CAS 13734-41-3

    BUILDING BLOCK

    PharmaCompass
    Xls

    Filters

    clear-filterReset all filters
    2D Structure
    Also known as: 13734-41-3, Boc-val-oh, N-(tert-butoxycarbonyl)-l-valine, N-boc-l-valine, Tert-butoxycarbonylvaline, (s)-2-(boc-amino)-3-methylbutyric acid
    Molecular Formula
    C10H19NO4
    Molecular Weight
    217.26  g/mol
    InChI Key
    SZXBQTSZISFIAO-ZETCQYMHSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
    2.1.2 InChI
    InChI=1S/C10H19NO4/c1-6(2)7(8(12)13)11-9(14)15-10(3,4)5/h6-7H,1-5H3,(H,11,14)(H,12,13)/t7-/m0/s1
    2.1.3 InChI Key
    SZXBQTSZISFIAO-ZETCQYMHSA-N
    2.1.4 Canonical SMILES
    CC(C)C(C(=O)O)NC(=O)OC(C)(C)C
    2.1.5 Isomeric SMILES
    CC(C)[C@@H](C(=O)O)NC(=O)OC(C)(C)C
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 13734-41-3

    2. Boc-val-oh

    3. N-(tert-butoxycarbonyl)-l-valine

    4. N-boc-l-valine

    5. Tert-butoxycarbonylvaline

    6. (s)-2-(boc-amino)-3-methylbutyric Acid

    7. Boc-l-val-oh

    8. Boc-valine

    9. Tert-butoxycarbonyl-l-valine

    10. N-tert-butoxycarbonyl-l-valine

    11. N-tert-butyloxycarbonyl-l-valine

    12. (s)-2-((tert-butoxycarbonyl)amino)-3-methylbutanoic Acid

    13. N-tert-butoxycarbonylvaline

    14. Mfcd00065605

    15. L-valine, N-[(1,1-dimethylethoxy)carbonyl]-

    16. N-(tert-butoxycarbonyl)valine

    17. N-((1,1-dimethylethoxy)carbonyl)-l-valine

    18. Valine, N-[(1,1-dimethylethoxy)carbonyl]-

    19. Valine, N-carboxy-, N-tert-butyl Ester, L-

    20. (2s)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic Acid

    21. (2s)-2-[(tert-butoxycarbonyl)amino]-3-methylbutanoic Acid

    22. L-valine, N-((1,1-dimethylethoxy)carbonyl)-

    23. (s)-2-(tert-butoxycarbonylamino)-3-methylbutanoic Acid

    24. (2s)-2-{[(tert-butoxy)carbonyl]amino}-3-methylbutanoic Acid

    25. N-[(1,1-dimethylethoxy)carbonyl]-l-valine

    26. (2s)-2-[[(tert-butoxy)carbonyl]amino]-3-methylbutanoic Acid

    27. Bocvaloh

    28. N-boc Valine

    29. Boc-valoh

    30. N-boc-valine

    31. N-t-boc-l-val

    32. (s)-n-boc-valine

    33. Boc-l-valin

    34. Einecs 237-307-6

    35. N-boc-(l)-valine

    36. (s)-boc-valine

    37. Boc-(l)-valine

    38. T-butoxycarbonylvaline

    39. Boc-nh-val-oh

    40. N-boc-val-oh

    41. (tert-butoxycarbonyl)-l-valine

    42. Nsc 197197

    43. N-t-butyloxycarbonyl-n-methyl-l-valine

    44. Boc-(l)-val

    45. Boc-val

    46. Boc-valine-oh

    47. Boc-(l)-val-oh

    48. N-t-butoxycarbonylvaline

    49. (s)-2-(boc-amino)pentanoic Acid

    50. T-butoxycarbonyl-l-valine

    51. N-t-boc-l-valine

    52. Unii-28r8gk7lbc

    53. Ec 237-307-6

    54. N-t-butyloxycarbonyl-valine

    55. T-butyloxycarbonyl-l-valine

    56. 28r8gk7lbc

    57. Schembl59323

    58. N-t-butyloxycarbonyl-l-valine

    59. Tert-butyloxycarbonyl-l-valine

    60. N-(t-butoxycarbonyl)-l-valine

    61. N-tert-butoxycarbonyl L-valine

    62. (s)-n-tert-butoxycarbonylvaline

    63. Tertiarybutyloxycarbonyl-l-valine

    64. N-(tert -butoxycarbonyl)-valine

    65. Dtxsid50884635

    66. N-(tert-butoxycarbony1)-l-valine

    67. N-t-butoxycarbonyl-l-valine

    68. (2s)-2-{[(tert-butoxy)carbonyl]amino}-3-methyl-butanoic Acid

    69. Act03117

    70. Albb-015814

    71. N-(tert-butyloxycarbonyl)-l-valine

    72. N-tert-butyloxycarbonyl-(l)-valine

    73. Zinc2170237

    74. N-((tert-butoxy)carbonyl)-l-valine

    75. N-(tert-butoxycarbonyl)-(l)-valine

    76. Akos005175164

    77. Akos015841611

    78. Am82367

    79. Boc-val-oh, >=99.0% (t)

    80. Cs-w002300

    81. Hy-w002300

    82. Ac-17119

    83. As-12728

    84. Bp-12966

    85. Bp-23488

    86. N-alpha-t-butyloxycarbonyl-l-valine

    87. A9890

    88. M03340

    89. N-{[(1,1-dimethylethyl)oxy]carbonyl}-l-valine

    90. (2s)-tert-butoxycarbonylamino-3-methylbutyric Acid

    91. (s)-2-tertbutoxycarbonylamino-3-methylbutyric Acid

    92. 734b413

    93. (s)-2-tert-butoxycarbonylamino-3-methylbutyric Acid

    94. J-300295

    95. Q-200740

    96. (s)-2-(t-butoxycarbonylamino)-3-methylbutanoic Acid

    97. (s)-2-tert-butoxycarbonylamino-3-methyl-butyric Acid

    98. (s)-2-tert-butoxycarbonylamino-3-methylbutanoic Acid

    99. F0001-0471

    100. Z1416203180

    101. (s)-2-((tert-butoxycarbonyl) Amino)-3-methylbutanoic Acid

    102. (s)-2-[[(tert-butoxy)carbonyl]amino]-3-methylbutanoic Acid

    103. (2s)-2-[(1,1-dimethylethoxy)carbonylamino]-3-methylbutanoic Acid

    2.3 Create Date
    2005-07-11
    3 Chemical and Physical Properties
    Molecular Weight 217.26 g/mol
    Molecular Formula C10H19NO4
    XLogP31.5
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count5
    Exact Mass217.13140809 g/mol
    Monoisotopic Mass217.13140809 g/mol
    Topological Polar Surface Area75.6 Ų
    Heavy Atom Count15
    Formal Charge0
    Complexity242
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1