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CS-W001157 4
Total: USD 88.00

1-(3,4-Dimethoxyphenyl)pentan-1-one

  • CAS No. 66053-97-2

  • Cat. No. CS-0551941
  • Molecule weight222.28
  • Purity≥98%
  • MDL No.None

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

1-(3,4-Dimethoxyphenyl)pentan-1-one|CS-0551941

Structure of 66053-97-2

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General Information

  • CAS No. 66053-97-2
  • Cat. No. CS-0551941
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₈O₃
  • Molecular Weight 222.28
  • Synonym(s) 1-(3,4-DIMETHOXY-PHENYL)-PENTAN-1-ONE
  • SMILES CCCCC(=O)C1=CC(=C(C=C1)OC)OC

Synthesis

  • Route1
    • null|null
      693-03-8
    • Veratraldehyde Verapamil Impurity|CS-0229507
      120-14-9
    • ~83%
    • 1-(3,4-Dimethoxyphenyl)pentan-1-one|CS-0551941
      66053-97-2

    References

    • Sagara, Prateep Singh; Chebolu, Rajesh; Bahuguna, Ashish; Ravikumar RSC Advances, 2014 , vol. 4, # 29 p. 15011 - 15013
  • Route2

    References

    • Celgene Corporation Patent: US6429221 B1, 2002 ;
  • Route3

    References

    • Mukaiyama, Teruaki; Ohno, Takashi; Nishimura, Takashi; Suda, Shinji; Kobayashi, Shu Chemistry Letters, 1991 , # 6 p. 1059 - 1062 Title/Abstract Full Text Show Details Harada; Ohno; Kobayashi; Mukaiyama Synthesis, 1991 , # 12 p. 1216 - 1220

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   35.53
  • LogP   3.0767
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   6

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