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CS-W001157 4
Total: USD 88.00

1-Methoxy-5-methylcyclohexa-1,4-diene

  • CAS No. 13697-84-2

  • Cat. No. CS-0227206
  • Molecule weight124.18
  • Purity≥98%
  • MDL No.None

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

1-Methoxy-5-methylcyclohexa-1,4-diene|CS-0227206

Structure of 13697-84-2

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General Information

  • CAS No. 13697-84-2
  • Cat. No. CS-0227206
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₂O
  • Molecular Weight 124.18
  • Synonym(s) 2,5-Dihydro-3-methylanisole
  • SMILES CC1=CCC=C(OC)C1

Synthesis

  • Route1

    References

    • Ndibwami, Alexis; Lamothe, Serge; Guay, Daniel; Plante, Raymond; Soucy, Pierre; et al. Canadian Journal of Chemistry, 1993 , vol. 71, # 5 p. 695 - 713
  • Route2
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      98677-97-5
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    • 1-Methoxy-5-methylcyclohexa-1,4-diene|CS-0227206
      13697-84-2
    • null|null
      2161-93-5

    References

    • Taskinen, Esko; Nummelin, Kari Journal of Organic Chemistry, 1985 , vol. 50, # 24 p. 4844 - 4847
  • Route3
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      4493-67-8
    • ~%
    • 1-Methoxy-5-methylcyclohexa-1,4-diene|CS-0227206
      13697-84-2

    References

    • Birch Journal of the Chemical Society, 1947 , p. 102,104

Safety Information

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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   2.2568
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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