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CS-W001157 4
Total: USD 88.00

3,5-dimethyl-1,2-oxazole-4-carbonitrile

  • CAS No. 31301-46-9

  • Cat. No. CS-0206402
  • Purity95+%
  • MDL No.MFCD02681974

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

3,5-dimethyl-1,2-oxazole-4-carbonitrile|CS-0206402

Structure of 31301-46-9

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General Information

  • CAS No. 31301-46-9
  • Cat. No. CS-0206402
  • Purity 95+%
  • MDL No. MFCD02681974
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₆N₂O
  • Molecular Weight 122.12
  • Synonym(s) 4-Cyano-3,5-dimethylisoxazole
  • SMILES CC1=NOC(=C1C#N)C

Synthesis

  • Route1
    • null|null
      108086-95-9
    • ~66%
    • 3,5-dimethyl-1,2-oxazole-4-carbonitrile|CS-0206402
      31301-46-9

    References

    • Alberola; Antolin; Gonzalez; et al. Journal of Heterocyclic Chemistry, 1986 , vol. 23, # 4 p. 1035 - 1038
  • Route2
    • null|null
      6081-80-7
    • ~64%
    • 3,5-dimethyl-1,2-oxazole-4-carbonitrile|CS-0206402
      31301-46-9

    References

    • Alberola; Antolin; Gonzalez; et al. Journal of Heterocyclic Chemistry, 1986 , vol. 23, # 4 p. 1035 - 1038
  • Route3
    • 1-(5-Methylisoxazol-4-yl)ethan-1-one|CS-0099924
      6497-21-8
    • ~%
    • 3,5-dimethyl-1,2-oxazole-4-carbonitrile|CS-0206402
      31301-46-9

    References

    • Journal of Heterocyclic Chemistry, , vol. 23, # 4 p. 1035 - 1038

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+H312+H332-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   49.82
  • LogP   1.16312
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   0

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