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CS-W001157 4
Total: USD 88.00

3-Methoxy-4-fluorobenzoic acid

  • CAS No. 82846-18-2

  • Cat. No. CS-W017707
  • Purity≥98%
  • MDL No.MFCD00272134

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

3-Methoxy-4-fluorobenzoic acid|CS-W017707

Structure of 82846-18-2

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General Information

  • CAS No. 82846-18-2
  • Cat. No. CS-W017707
  • Purity ≥98%
  • MDL No. MFCD00272134
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇FO₃
  • Molecular Weight 170.14
  • Synonym(s) 4-Fluoro-m-anisic Acid
  • SMILES COC1=C(C=CC(=C1)C(=O)O)F

Synthesis

  • Route1

    References

    • BIOENERGENIX; MCCALL, John; KELLY, Robert, C.; ROMERO, Donna, L. Patent: WO2014/66795 A1, 2014 ; Location in patent: Paragraph 0175 ;
  • Route2

    References

    • Claudi, Francesco; Cardellini, Mario; Cingolani, Gian Mario; Piergentili, Alessandro; Pertuzzi, Guidubaldo; Balduini, Walter Journal of Medicinal Chemistry, 1990 , vol. 33, # 9 p. 2408 - 2412
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    References

    • Journal of Medicinal Chemistry, , vol. 33, # 9 p. 2408 - 2412

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   46.53
  • LogP   1.5325
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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