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Methyl 7-fluoro-6-(phenylamino)-1H-benzo[d]imidazole-5-carboxylate

  • CAS No. 606093-59-8

  • Cat. No. CS-0180878
  • Molecule weight285.27
  • Purity95+%
  • MDL No.MFCD12914278

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

Methyl 7-fluoro-6-(phenylamino)-1H-benzo[d]imidazole-5-carboxylate|CS-0180878

Structure of 606093-59-8

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General Information

  • CAS No. 606093-59-8
  • Cat. No. CS-0180878
  • Purity 95+%
  • MDL No. MFCD12914278
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₂FN₃O₂
  • Molecular Weight 285.27
  • Synonym(s) methyl 7-fluoro-6-(phenylamino)-3H-benzo[d]imidazole-5-carboxylate
  • SMILES O=C(C1=C(NC2=CC=CC=C2)C(F)=C3NC=NC3=C1)OC

Synthesis

  • Route1

    References

    • Wallace, Eli M.; Lyssikatos, Joseph P.; Marlow, Allison L.; Hurley, T. Brian Patent: US2003/232869 A1, 2003 ; Location in patent: Page 17 ; US 20030232869 A1
  • Route2

    References

    • Wallace, Eli M.; Lyssikatos, Joseph P.; Marlow, Allison L.; Hurley, T. Brian Patent: US2003/216460 A1, 2003 ; US 20030216460 A1

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   67.01
  • LogP   3.2322
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   3

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