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tert-Butyl(S)-(1-hydroxypent-4-yn-2-yl)carbamate

  • CAS No. 763122-73-2

  • Cat. No. CS-0170794
  • Purity≥96%
  • MDL No.None

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

tert-Butyl(S)-(1-hydroxypent-4-yn-2-yl)carbamate|CS-0170794

Structure of 763122-73-2

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General Information

  • CAS No. 763122-73-2
  • Cat. No. CS-0170794
  • Purity ≥96%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₇NO₃
  • Molecular Weight 199.25
  • Synonym(s) Carbamic acid, [(1S)-1-(hydroxymethyl)-3-butynyl]-, 1,1-dimethylethyl ester
  • SMILES C#CC[C@H](NC(OC(C)(C)C)=O)CO

Synthesis

  • Route1
    • 2-((tert-Butoxycarbonyl)amino)pent-4-ynoic acid|CS-0106941
      61172-66-5
    • ~%
    • In-stock
      tert-Butyl(S)-(1-hydroxypent-4-yn-2-yl)carbamate|CS-0170794
      763122-73-2

    References

    • SMITHKLINE BEECHAM CORPORATION Patent: WO2005/85227 A1, 2005 ; Location in patent: Page/Page column 54; 144 ; WO 2005/085227 A1
  • Route2
    • null|null
      151139-90-1
    • ~87%
    • In-stock
      tert-Butyl(S)-(1-hydroxypent-4-yn-2-yl)carbamate|CS-0170794
      763122-73-2

    References

    • Dondoni, Alessandro; Giovannini, Pier Paolo; Massi, Alessandro Organic Letters, 2004 , vol. 6, # 17 p. 2929 - 2932

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H303-H313-H333
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   0.8953
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   3

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