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(4-Fluoro-benzenesulfonyl)-acetic acid

  • CAS No. 383-38-0

  • Cat. No. CS-0072451
  • Purity≥97%
  • MDL No.MFCD06208191

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

(4-Fluoro-benzenesulfonyl)-acetic acid|CS-0072451

Structure of 383-38-0

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General Information

  • CAS No. 383-38-0
  • Cat. No. CS-0072451
  • Purity ≥97%
  • MDL No. MFCD06208191
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇FO₄S
  • Molecular Weight 218.20
  • Synonym(s) IFLAB-BB F2109-0036
  • SMILES O=S(CC(O)=O)(C(C=C1)=CC=C1F)=O

Synthesis

  • Route1

    References

    • Mirskova, A.N.; Kryukova, Yu.I.; Levkovskaya, G.G.; Guseva, S.A.; Voronkov, M.G. Journal of Organic Chemistry USSR (English Translation), 1984 , vol. 20, # 3 p. 545 - 550 Zhurnal Organicheskoi Khimii, 1984 , vol. 20, # 3 p. 602 - 608
  • Route2
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    • (4-Fluoro-benzenesulfonyl)-acetic acid|CS-0072451
      383-38-0

    References

    • Hann Journal of the American Chemical Society, 1935 , vol. 57, p. 2166
  • Route3

    References

    • Pasto,D.J. et al. Journal of Organic Chemistry, 1965 , vol. 30, p. 2688 - 2691

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

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Computational Chemistry Data

  • TPSA   71.44
  • LogP   0.684
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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