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CS-W001157 4
Total: USD 88.00

Methyl 4-(thiophen-3-yl)benzoate

  • CAS No. 20608-91-7

  • Cat. No. CS-0316358
  • Purity≥98%
  • MDL No.None

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

Methyl 4-(thiophen-3-yl)benzoate|CS-0316358

Structure of 20608-91-7

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General Information

  • CAS No. 20608-91-7
  • Cat. No. CS-0316358
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₀O₂S
  • Molecular Weight 218.27
  • Synonym(s) Methyl 4-(3-thienyl)benzoate
  • SMILES COC(=O)C1=CC=C(C=C1)C2=CSC=C2

Synthesis

  • Route1
    • 5,5-Dimethyl-2-(thiophen-3-yl)-1,3,2-dioxaborinane|CS-0439117
      905966-46-3
    • Methyl 4-((N,N-dimethylsulfamoyl)oxy)benzoate|CS-0600399
      338396-06-8
    • ~98%
    • In-stock
      Methyl 4-(thiophen-3-yl)benzoate|CS-0316358
      20608-91-7

    References

    • Leowanawat, Pawaret; Zhang, Na; Resmerita, Ana-Maria; Rosen, Brad M.; Percec, Virgil Journal of Organic Chemistry, 2011 , vol. 76, # 24 p. 9946 - 9955
  • Route2
    • 5,5-Dimethyl-2-(thiophen-3-yl)-1,3,2-dioxaborinane|CS-0439117
      905966-46-3
    • null|null
      161497-18-3
    • ~97%
    • In-stock
      Methyl 4-(thiophen-3-yl)benzoate|CS-0316358
      20608-91-7

    References

    • Leowanawat, Pawaret; Zhang, Na; Resmerita, Ana-Maria; Rosen, Brad M.; Percec, Virgil Journal of Organic Chemistry, 2011 , vol. 76, # 24 p. 9946 - 9955
  • Route3

    References

    • Journal of Organic Chemistry, , vol. 76, # 24 p. 9946 - 9955

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H302-H318
Precautionary Statements : P264-P270-P280-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   3.2017
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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