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CS-W001157 4
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1-Methoxy-3-(3-methylbut-3-en-1-yl)benzene

  • CAS No. 40463-03-4

  • Cat. No. CS-0575303
  • Molecule weight176.25
  • Purity≥98%
  • MDL No.None

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

1-Methoxy-3-(3-methylbut-3-en-1-yl)benzene|CS-0575303

Structure of 40463-03-4

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General Information

  • CAS No. 40463-03-4
  • Cat. No. CS-0575303
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₆O
  • Molecular Weight 176.25
  • Synonym(s) 1-Methoxy-3-(3-methyl-3-butenyl)benzene
  • SMILES CC(=C)CCC1=CC(=CC=C1)OC

Synthesis

  • Route1
    • null|null
      90433-21-9
    • ~27%
    • 1-Methoxy-3-(3-methylbut-3-en-1-yl)benzene|CS-0575303
      40463-03-4
    • null|null
      72390-19-3
    • 1-Methoxy-3-(3-methylbut-2-en-1-yl)benzene|CS-1033560
      18272-91-8

    References

    • Zimmerman, Howard E.; Swafford, Richard L. Journal of Organic Chemistry, 1984 , vol. 49, # 17 p. 3069 - 3083
  • Route2
    • null|null
      84565-67-3
    • ~10%
    • 1-Methoxy-3-(3-methylbut-3-en-1-yl)benzene|CS-0575303
      40463-03-4
    • null|null
      72390-19-3
    • null|null
      90433-21-9
    • 1-Methoxy-3-(3-methylbut-2-en-1-yl)benzene|CS-1033560
      18272-91-8

    References

    • Zimmerman, Howard E.; Swafford, Richard L. Journal of Organic Chemistry, 1984 , vol. 49, # 17 p. 3069 - 3083
  • Route3
    • null|null
      824-98-6
    • null|null
      563-47-3
    • ~%
    • 1-Methoxy-3-(3-methylbut-3-en-1-yl)benzene|CS-0575303
      40463-03-4

    References

    • Julia,M.; Labia,R. Bulletin de la Societe Chimique de France, 1972 , p. 4151 - 4157

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   9.23
  • LogP   3.2039
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   4

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