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CS-W001157 4
Total: USD 88.00

(S)-2-((tert-Butoxycarbonyl)amino)-3-(4-cyanophenyl)propanoic acid

  • CAS No. 131724-45-3

  • Cat. No. CS-W008561
  • Molecule weightNone
  • Purity≥97%
  • MDL No.MFCD00672526

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

(S)-2-((tert-Butoxycarbonyl)amino)-3-(4-cyanophenyl)propanoic acid|CS-W008561

Structure of 131724-45-3

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General Information

  • CAS No. 131724-45-3
  • Cat. No. CS-W008561
  • Purity ≥97%
  • MDL No. MFCD00672526
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₈N₂O₄
  • Molecular Weight None
  • Synonym(s) N-Boc-4-cyano-L-phenylalanine
  • SMILES O=C(O)[C@H](CC1=CC=C(C#N)C=C1)NC(OC(C)(C)C)=O

Synthesis

  • Route1
    • null|null
      123-91-1
    • In-stock
      Di-tert-butyl dicarbonate|CS-0017817
      24424-99-5
    • Diethyl 2-acetamido-2-(4-cyanobenzyl)malonate|CS-0666626
      52117-01-8
    • ~%
    • In-stock
      (S)-2-((tert-Butoxycarbonyl)amino)-3-(4-cyanophenyl)propanoic acid|CS-W008561
      131724-45-3

    References

    • US6265418 B1, ;
  • Route2

    References

    • US5574016 A1, ;
  • Route3
    • In-stock
      Di-tert-butyl dicarbonate|CS-0017817
      24424-99-5
    • null|null
      80852-36-4
    • ~44%
    • In-stock
      (S)-2-((tert-Butoxycarbonyl)amino)-3-(4-cyanophenyl)propanoic acid|CS-W008561
      131724-45-3

    References

    • Saupe, Sebastian M.; Steinmetzer, Torsten Journal of Medicinal Chemistry, 2012 , vol. 55, # 3 p. 1171 - 1180

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 3439
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P280-P302+P352

Quality Control

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Computational Chemistry Data

  • TPSA   99.42
  • LogP   2.07868
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   4

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