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CS-W001157 4
Total: USD 88.00

3-Fluoro-5-(methoxycarbonyl)benzoic acid

  • CAS No. 660416-36-4

  • Cat. No. CS-0130325
  • Purity≥98%
  • MDL No.None

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

3-Fluoro-5-(methoxycarbonyl)benzoic acid|CS-0130325

Structure of 660416-36-4

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General Information

  • CAS No. 660416-36-4
  • Cat. No. CS-0130325
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇FO₄
  • Molecular Weight 198.15
  • Synonym(s) 5-fluoroisophthalic acid monomethyl ester
  • SMILES O=C(C1=CC(C(OC)=O)=CC(F)=C1)O

Synthesis

  • Route1

    References

    • ASTRA ZENECA AB; NPS PHARMACEUTICALS, INC. Patent: WO2004/14881 A2, 2004 ; Location in patent: Page 100-101 ; WO 2004/014881 A2

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   63.6
  • LogP   1.3105
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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