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CS-W001157 4
Total: USD 88.00

(S)-4-Benzyl-5-oxomorpholine-3-carboxylic acid

  • CAS No. 106973-37-9

  • Cat. No. CS-0128614
  • Purity≥97%
  • MDL No.MFCD09835535

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

(S)-4-Benzyl-5-oxomorpholine-3-carboxylic acid|CS-0128614

Structure of 106973-37-9

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General Information

  • CAS No. 106973-37-9
  • Cat. No. CS-0128614
  • Purity ≥97%
  • MDL No. MFCD09835535
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₃NO₄
  • Molecular Weight 235.24
  • Synonym(s) (3S)-4-Benzyl-5-oxomorpholine-3-carboxylic acid
  • SMILES O=C([C@H](COC1)N(CC2=CC=CC=C2)C1=O)O

Synthesis

  • Route1
    • In-stock
      2-(Benzylamino)-3-hydroxypropanoic acid|CS-0437387
      106910-76-3
    • null|null
      79-04-9
    • ~84%
    • In-stock
      (S)-4-Benzyl-5-oxomorpholine-3-carboxylic acid|CS-0128614
      106973-37-9

    References

    • BRISTOL-MYERS SQUIBB COMPANY Patent: WO2005/58245 A2, 2005 ; Location in patent: Page/Page column 29-30 ; WO 2005/058245 A2
  • Route2
    • In-stock
      H-Ser-OH Amino acid impurity|CS-1733142
      56-45-1
    • null|null
      100-52-7
    • null|null
      79-04-9
    • ~%
    • In-stock
      (S)-4-Benzyl-5-oxomorpholine-3-carboxylic acid|CS-0128614
      106973-37-9

    References

    • Gavai, Ashvinikumar V.; Fink, Brian E.; Fairfax, David J.; Martin, Gregory S.; Rossiter, Lana M.; Holst, Christian L.; Kim, Soong-Hoon; Leavitt, Kenneth J.; Mastalerz, Harold; Han, Wen-Ching; Norris, Derek; Goyal, Bindu; Swaminathan, Shankar; Patel, Bharat; Mathur, Arvind; Vyas, Dolatrai M.; Tokarski, John S.; Chiang, Yu; Oppenheimer, Simone; Hongjian, Zhang; Marathe, Punit; Fargnoli, Joseph; Lee, Francis Y.; Wong, Tai W.; Vite, Gregory D. Journal of Medicinal Chemistry, 2009 , vol. 52, # 21 p. 6527 - 6530
  • Route3
    • null|null
      100-52-7
    • ~%
    • In-stock
      (S)-4-Benzyl-5-oxomorpholine-3-carboxylic acid|CS-0128614
      106973-37-9

    References

    • Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), , p. 2577 - 2580

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-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   66.84
  • LogP   0.4986
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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