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CS-W001157 4
Total: USD 88.00

3-Phenylisoxazole

  • CAS No. 1006-65-1

  • Cat. No. CS-0439696
  • Molecule weight145.16
  • Purity≥98%
  • MDL No.None

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

3-Phenylisoxazole|CS-0439696

Structure of 1006-65-1

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General Information

  • CAS No. 1006-65-1
  • Cat. No. CS-0439696
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇NO
  • Molecular Weight 145.16
  • Synonym(s) 3-phenyl-1,2-oxazole
  • SMILES C1=CC=C(C=C1)C2=NOC=C2

Synthesis

  • Route1
    • null|null
      7041-68-1
    • ~91%
    • 3-Phenylisoxazole|CS-0439696
      1006-65-1

    References

    • Koroleva; Bondar; Katok; Chekanov; Chernikhova Chemistry of Heterocyclic Compounds, 2007 , vol. 43, # 3 p. 362 - 369
  • Route2
    • 7-(Tert-butyl) 2,3-dimethyl 7-azabicyclo[2.2.1]hepta-2,5-diene-2,3,7-tricarboxylate|CS-1161921
      114221-05-5
    • null|null
      934-16-7
    • ~17%
    • 3-Phenylisoxazole|CS-0439696
      1006-65-1
    • In-stock
      N-BOC-pyrrole|CS-D0903
      5176-27-2
    • null|null
      114221-06-6
    • null|null
      7710-44-3

    References

    • Keana, John F. W.; Heo, Gwi Suk; Mann, Jeffry S.; Nice, Faith L. Van; Lex, Laszlo; et al. Journal of Organic Chemistry, 1988 , vol. 53, # 10 p. 2268 - 2274
  • Route3
    • null|null
      42970-55-8
    • ~88%
    • 3-Phenylisoxazole|CS-0439696
      1006-65-1

    References

    • Padwa, Albert; Stengel, Thomas Tetrahedron Letters, 2004 , vol. 45, # 31 p. 5991 - 5993

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   26.03
  • LogP   2.3416
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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