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tert-Butyl 5-amino-2-fluorobenzoate

  • CAS No. 853070-30-1

  • Cat. No. CS-0311588
  • Molecule weight211.23
  • Purity95+%
  • MDL No.MFCD09037864

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

tert-Butyl 5-amino-2-fluorobenzoate|CS-0311588

Structure of 853070-30-1

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General Information

  • CAS No. 853070-30-1
  • Cat. No. CS-0311588
  • Purity 95+%
  • MDL No. MFCD09037864
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄FNO₂
  • Molecular Weight 211.23
  • Synonym(s) TERT-BUTYL5-AMINO-2-FLUOROBENZOATE
  • SMILES O=C(OC(C)(C)C)C1=CC(N)=CC=C1F

Synthesis

  • Route1
    • Tert-butyl 2-fluoro-5-nitrobenzoate|CS-0453274
      526218-22-4
    • ~%
    • tert-Butyl 5-amino-2-fluorobenzoate|CS-0311588
      853070-30-1

    References

    • Dainippon Sumitomo Pharma Co., Ltd. Patent: EP1690863 A1, 2006 ; Location in patent: Page/Page column 177 ;

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   52.32
  • LogP   2.3632
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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