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CS-W001157 4
Total: USD 88.00

Boc-Valinol

  • CAS No. 79069-14-0

  • Cat. No. CS-W015451
  • Purity≥97%
  • MDL No.MFCD00082635

*For research and further manufacturing use only, not for direct human use.

Boc-Valinol|CS-W015451

Structure of 79069-14-0

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General Information

  • CAS No. 79069-14-0
  • Cat. No. CS-W015451
  • Purity ≥97%
  • MDL No. MFCD00082635
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₂₁NO₃
  • Molecular Weight 203.28
  • Synonym(s) tert-butyl [(1S)-1-(hydroxymethyl)-2-methylpropyl]carbamate
  • SMILES O=C(OC(C)(C)C)N[C@H](CO)C(C)C

Application

Boc-Valinol serves as a versatile chiral building block in peptide synthesis and medicinal chemistry, enabling the introduction of valine-derived side chains with high stereochemical integrity. The Boc group provides excellent stability under basic conditions and facilitates straightforward deprotection using mild acids. Its hydroxyl functionality allows for selective derivatization, including ether formation and esterification, while maintaining compatibility with common coupling reagents and protecting group strategies. This makes Boc-Valinol particularly useful in constructing complex scaffolds and fragment-based libraries.

Synthesis

  • Route1

    References

    • Kuriyama, Wataru; Ino, Yasunori; Ogata, Osamu; Sayo, Noboru; Saito, Takao Advanced Synthesis and Catalysis, 2010 , vol. 352, # 1 p. 92 - 96
  • Route2

    References

    • Rotstein, Benjamin H.; Yudin, Andrei K. Synthesis (Germany), 2012 , vol. 44, # 18 p. 2851 - 2858
  • Route3

    References

    • Myllymaeki, Vesa T.; Lindvall, Mika K.; Koskinen, Ari M. P. Tetrahedron, 2001 , vol. 57, # 21 p. 4629 - 4635

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   58.56
  • LogP   1.528
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   3

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