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CS-W001157 4
Total: USD 88.00

Methyl 5,6-dibromonicotinate

  • CAS No. 78686-81-4

  • Cat. No. CS-0539977
  • Molecule weight294.93
  • Purity≥98%
  • MDL No.MFCD14698021

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

Methyl 5,6-dibromonicotinate|CS-0539977

Structure of 78686-81-4

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General Information

  • CAS No. 78686-81-4
  • Cat. No. CS-0539977
  • Purity ≥98%
  • MDL No. MFCD14698021
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅Br₂NO₂
  • Molecular Weight 294.93
  • Synonym(s) methyl 5,6-dibromopyridine-3-carboxylate
  • SMILES COC(=O)C1=CC(=C(N=C1)Br)Br

Synthesis

  • Route1

    References

    • ASTRAZENECA AB; ASTRAZENECA UK LIMITED Patent: WO2009/106885 A1, 2009 ; Location in patent: Page/Page column 297 ; WO 2009/106885 A1
  • Route2
    • null|null
      186581-53-3
    • In-stock
      5,6-Dibromonicotinic acid|CS-0041188
      29241-64-3
    • ~89%
    • In-stock
      Methyl 5,6-dibromonicotinate|CS-0539977
      78686-81-4

    References

    • Setliff, Frank L.; Hule, W. Reeves Journal of Chemical & Engineering Data, 1981 , vol. 26, # 3 p. 332 - 333

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   39.19
  • LogP   2.3932
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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