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CS-W001157 4
Total: USD 88.00

3-(Thiophen-2-yl)benzoic acid

  • CAS No. 29886-63-3

  • Cat. No. CS-0206662
  • Purity≥98%
  • MDL No.MFCD03783346

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

3-(Thiophen-2-yl)benzoic acid|CS-0206662

Structure of 29886-63-3

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General Information

  • CAS No. 29886-63-3
  • Cat. No. CS-0206662
  • Purity ≥98%
  • MDL No. MFCD03783346
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₈O₂S
  • Molecular Weight 204.25
  • Synonym(s) 3-(2-Thienyl)benzoic acid
  • SMILES C1=CC(=CC(=C1)C(=O)O)C2=CC=CS2

Synthesis

  • Route1
    • Methyl 3-(thiophen-2-yl)benzoate|CS-0779948
      17595-85-6
    • ~91%
    • 3-(Thiophen-2-yl)benzoic acid|CS-0206662
      29886-63-3

    References

    • Fujisawa Pharmaceutical Co., Ltd. Patent: US6770667 B1, 2004 ; Location in patent: Page column 9 ;
  • Route2

    References

    • Tetrahedron Letters, , vol. 39, # 24 p. 4175 - 4178

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P301+P310-P302+P352-P304+P341-P312-P330-P363-P501

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   3.1133
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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