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CS-W001157 4
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2-{2-[(tert-butoxy)carbonyl]phenyl}acetic acid

  • CAS No. 168072-81-9

  • Cat. No. CS-0215944
  • Purity≥98%
  • MDL No.None

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

2-{2-[(tert-butoxy)carbonyl]phenyl}acetic acid|CS-0215944

Structure of 168072-81-9

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General Information

  • CAS No. 168072-81-9
  • Cat. No. CS-0215944
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₆O₄
  • Molecular Weight 236.26
  • Synonym(s) 2-Carboxymethylbenzoicacidtert-butylester
  • SMILES CC(C)(C)OC(=O)C1=CC=CC=C1CC(=O)O

Synthesis

  • Route1

    References

    • Leenders; Leenders, Ruben G.G.; Gerrits; Gerrits, Kasper A. A.; Ruijtenbeek; Ruijtenbeek, Rob; Scheeren; Scheeren, Hans W.; Haisma; Haisma, Hidde J.; Boven; Boven, Epie Tetrahedron Letters, 1995 , vol. 36, # 10 p. 1701 - 1704
  • Route2
    • null|null
      168072-80-8
    • ~%
    • 2-{2-[(tert-butoxy)carbonyl]phenyl}acetic acid|CS-0215944
      168072-81-9

    References

    • Leenders; Leenders, Ruben G.G.; Gerrits; Gerrits, Kasper A. A.; Ruijtenbeek; Ruijtenbeek, Rob; Scheeren; Scheeren, Hans W.; Haisma; Haisma, Hidde J.; Boven; Boven, Epie Tetrahedron Letters, 1995 , vol. 36, # 10 p. 1701 - 1704

Safety Information

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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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   63.6
  • LogP   2.269
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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