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CS-W001157 4
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4-(3,4-Dimethoxyphenyl)-2-butanone

  • CAS No. 6302-60-9

  • Cat. No. CS-0117240
  • Molecule weight208.25
  • Purity≥98%
  • MDL No.None

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

4-(3,4-Dimethoxyphenyl)-2-butanone|CS-0117240

Structure of 6302-60-9

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General Information

  • CAS No. 6302-60-9
  • Cat. No. CS-0117240
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₆O₃
  • Molecular Weight 208.25
  • Synonym(s) 4-(3,4-Dimethoxyphenyl)butan-2-one
  • SMILES CC(CCC1=CC=C(OC)C(OC)=C1)=O

Synthesis

  • Route1

    References

    • Dhuru, Sameer; Bhedi, Dilip; Gophane, Dnyaneshwar; Hirbhagat, Kiran; Nadar, Vijaya; More, Dattatray; Parikh, Sapna; Dalal, Roda; Fonseca, Lyle C.; Kharas, Firuza; Vadnal, Prashant Y.; Vishwakarma, Ram A.; Sivaramakrishnan Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 12 p. 3784 - 3787
  • Route2

    References

    • Sharma, Anuj; Kumar, Vinod; Sinha, Arun K. Advanced Synthesis and Catalysis, 2006 , vol. 348, # 3 p. 354 - 360
  • Route3

    References

    • Sanfilippo, Claudia; Patti, Angela; Dettori, Maria Antonietta; Fabbri, Davide; Delogu, Giovanna Journal of Molecular Catalysis B: Enzymatic, 2013 , vol. 90, p. 107 - 113

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   2.2254
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   5

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