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Methyl 5-(2-bromophenyl)-1H-pyrazole-3-carboxylate

  • CAS No. 1035235-11-0

  • Cat. No. CS-0200134
  • Purity≥98%
  • MDL No.None

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

Methyl 5-(2-bromophenyl)-1H-pyrazole-3-carboxylate|CS-0200134

Structure of 1035235-11-0

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General Information

  • CAS No. 1035235-11-0
  • Cat. No. CS-0200134
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₉BrN₂O₂
  • Molecular Weight 281.11
  • Synonym(s) Methyl-3-(2-bromophenyl)-1H-pyrazole-5-carboxylate
  • SMILES COC(=O)C1=NNC(=C1)C2=CC=CC=C2Br

Synthesis

  • Route1
    • In-stock
      Methyl 4-(2-bromophenyl)-2,4-dioxobutanoate|CS-0161006
      1035235-10-9
    • ~97%
    • In-stock
      Methyl 5-(2-bromophenyl)-1H-pyrazole-3-carboxylate|CS-0200134
      1035235-11-0

    References

    • Millennium Pharmaceuticals, Inc. Patent: US2008/171754 A1, 2008 ; Location in patent: Page/Page column 97-98 ; US 20080171754 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-H332-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   54.98
  • LogP   2.6258
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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