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CS-W001157 4
Total: USD 88.00

2-(2-(((tert-butoxycarbonyl)amino)methyl)phenyl)acetic acid

  • CAS No. 40851-66-9

  • Cat. No. CS-0067868
  • Purity≥97%
  • MDL No.MFCD06656428

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

2-(2-(((tert-butoxycarbonyl)amino)methyl)phenyl)acetic acid|CS-0067868

Structure of 40851-66-9

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General Information

  • CAS No. 40851-66-9
  • Cat. No. CS-0067868
  • Purity ≥97%
  • MDL No. MFCD06656428
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₉NO₄
  • Molecular Weight 265.30
  • Synonym(s) 2-(Boc-aminomethyl)phenylacetic acid
  • SMILES O=C(O)CC1=CC=CC=C1CNC(OC(C)(C)C)=O

Synthesis

  • Route1
    • Methyl 2-(2-(((tert-butoxycarbonyl)amino)methyl)phenyl)acetate|CS-0726721
      147410-31-9
    • ~97%
    • In-stock
      2-(2-(((tert-butoxycarbonyl)amino)methyl)phenyl)acetic acid|CS-0067868
      40851-66-9

    References

    • Le Bourdonnec, Bertrand; Ajello, Christopher William; Dolle, Roland E. Patent: US2004/254156 A1, 2004 ; Location in patent: Page 16 ;
  • Route2

    References

    • Le Bourdonnec, Bertrand; Ajello, Christopher W.; Seida, Pamela R.; Susnow, Roberta G.; Cassel, Joel A.; Belanger, Serge; Stabley, Gabriel J.; DeHaven, Robert N.; DeHaven-Hudkins, Diane L.; Dolle, Roland E. Bioorganic and Medicinal Chemistry Letters, 2005 , vol. 15, # 10 p. 2647 - 2652
  • Route3

    References

    • Le Bourdonnec, Bertrand; Ajello, Christopher W.; Seida, Pamela R.; Susnow, Roberta G.; Cassel, Joel A.; Belanger, Serge; Stabley, Gabriel J.; DeHaven, Robert N.; DeHaven-Hudkins, Diane L.; Dolle, Roland E. Bioorganic and Medicinal Chemistry Letters, 2005 , vol. 15, # 10 p. 2647 - 2652

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-H319
Precautionary Statements : P264-P270-P280-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   75.63
  • LogP   2.3384
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   4

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