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CS-W001157 4
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Methyl 3-(benzyloxy)isoxazole-5-carboxylate

  • CAS No. 205115-22-6

  • Cat. No. CS-0498227
  • Purity≥98%
  • MDL No.MFCD11499026

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

Methyl 3-(benzyloxy)isoxazole-5-carboxylate|CS-0498227

Structure of 205115-22-6

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General Information

  • CAS No. 205115-22-6
  • Cat. No. CS-0498227
  • Purity ≥98%
  • MDL No. MFCD11499026
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₁NO₄
  • Molecular Weight 233.22
  • Synonym(s) methyl 3-(benzyloxy)-1,2-oxazole-5-carboxylate
  • SMILES O=C(C1=CC(OCC2=CC=CC=C2)=NO1)OC

Synthesis

  • Route1

    References

    • ABBOTT LABORATORIES; ABBOTT GMBH and CO.KG; MARING, Clarence J.; PRATT, John K.; CARROLL, William A.; LIU, Dachun; BETEBENNER, David A.; HUTCHINSON, Douglas K.; TUFANO, Michael D.; ROCKWAY, Todd W.; SCHOEN, Uwe; PAHL, Axel; WITTE, Adreas Patent: WO2012/87833 A1, 2012 ; Location in patent: Page/Page column 132-133 ; WO 2012/087833 A1
  • Route2
    • null|null
      100-39-0
    • In-stock
      methyl 3-hydroxyisoxazole-5-carboxylate|CS-W000792
      10068-07-2
    • ~94%
    • Methyl 3-(benzyloxy)isoxazole-5-carboxylate|CS-0498227
      205115-22-6
    • null|null
      205115-33-9

    References

    • Riess, Regine; Schoen, Michael; Laschat, Sabine; Jaeger, Volker European Journal of Organic Chemistry, 1998 , # 3 p. 473 - 479

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   61.56
  • LogP   2.0402
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   4

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