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CS-W001157 4
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6-Fluoro-3,4-dihydro-2h-1-benzopyran-3-carboxylic acid

  • CAS No. 944899-27-8

  • Cat. No. CS-0224781
  • Molecule weight196.18
  • Purity≥98%
  • MDL No.None

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

6-Fluoro-3,4-dihydro-2h-1-benzopyran-3-carboxylic acid|CS-0224781

Structure of 944899-27-8

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General Information

  • CAS No. 944899-27-8
  • Cat. No. CS-0224781
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉FO₃
  • Molecular Weight 196.18
  • Synonym(s) 6-Fluorochroman-3-carboxylic acid
  • SMILES C1=C(C=C2CC(COC2=C1)C(=O)O)F

Synthesis

  • Route1

    References

    • Sessions, E. Hampton; Smolinski, Michael; Wang, Bo; Frackowiak, Bozena; Chowdhury, Sarwat; Yin, Yan; Chen, Yen Ting; Ruiz, Claudia; Lin, Li; Pocas, Jennifer; Schroeter, Thomas; Cameron, Michael D.; LoGrasso, Philip; Feng, Yangbo; Bannister, Thomas D. Bioorganic and Medicinal Chemistry Letters, 2010 , vol. 20, # 6 p. 1939 - 1943

Safety Information

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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   46.53
  • LogP   1.4614
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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