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CS-W001157 4
Total: USD 88.00

4,5-Dimethoxy-2-methylbenzonitrile

  • CAS No. 58814-69-0

  • Cat. No. CS-0539774
  • Molecule weight177.20
  • Purity≥98%
  • MDL No.None

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

4,5-Dimethoxy-2-methylbenzonitrile|CS-0539774

Structure of 58814-69-0

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General Information

  • CAS No. 58814-69-0
  • Cat. No. CS-0539774
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁NO₂
  • Molecular Weight 177.20
  • Synonym(s) Benzonitrile, 4,5-dimethoxy-2-methyl-
  • SMILES CC1=CC(=C(C=C1C#N)OC)OC

Synthesis

  • Route1
    • 1-Bromo-4,5-dimethoxy-2-methylbenzene|CS-0238579
      52806-46-9
    • null|null
      544-92-3
    • ~90%
    • 4,5-Dimethoxy-2-methylbenzonitrile|CS-0539774
      58814-69-0

    References

    • Davis, Franklin A.; Mohanty, Pradyumna K. Journal of Organic Chemistry, 2002 , vol. 67, # 4 p. 1290 - 1296
  • Route2

    References

    • Davis, Franklin A.; Mohanty, Pradyumna K. Journal of Organic Chemistry, 2002 , vol. 67, # 4 p. 1290 - 1296
  • Route3
    • null|null
      7509-11-7
    • ~%
    • 4,5-Dimethoxy-2-methylbenzonitrile|CS-0539774
      58814-69-0

    References

    • Luff; Perkin; Robinson Journal of the Chemical Society, 1910 , vol. 97, p. 1139

Safety Information

Download SDS
GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   42.25
  • LogP   1.8839
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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