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CS-W001157 4
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2-((4-((Tert-butoxycarbonyl)amino)phenyl)thio)acetic acid

  • CAS No. 447414-44-0

  • Cat. No. CS-0358332
  • Molecule weight283.34
  • Purity≥97%
  • MDL No.None

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

2-((4-((Tert-butoxycarbonyl)amino)phenyl)thio)acetic acid|CS-0358332

Structure of 447414-44-0

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General Information

  • CAS No. 447414-44-0
  • Cat. No. CS-0358332
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₇NO₄S
  • Molecular Weight 283.34
  • Synonym(s) (4-tert-butoxycarbonylaminophenylsulfanyl)acetic acid
  • SMILES CC(C)(C)OC(=O)NC1=CC=C(C=C1)SCC(=O)O

Synthesis

  • Route1

    References

    • Griffin, Roger J.; Henderson, Andrew; Curtin, Nicola J.; Echalier, Aude; Endicott, Jane A.; Hardcastle, Ian R.; Newell, David R.; Noble, Martin E. M.; Wang, Lan-Zhen; Golding, Bernard T. Journal of the American Chemical Society, 2006 , vol. 128, # 18 p. 6012 - 6013
  • Route2

    References

    • Cabiddu, Maria Grazia; Cabiddu, Salvatore; Cadoni, Enzo; De Montis, Stefania; Fattuoni, Claudia; Melis, Stefana Tetrahedron, 2003 , vol. 59, # 16 p. 2893 - 2897
  • Route3

    References

    • Cabiddu, Maria Grazia; Cabiddu, Salvatore; Cadoni, Enzo; De Montis, Stefania; Fattuoni, Claudia; Melis, Stefana Tetrahedron, 2003 , vol. 59, # 16 p. 2893 - 2897

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   75.63
  • LogP   3.2103
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   4

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