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CS-W001157 4
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Ethyl 4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate

  • CAS No. 951626-95-2

  • Cat. No. CS-0040200
  • Molecule weight209.20
  • Purity≥97%
  • MDL No.MFCD09832110

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

Ethyl 4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate|CS-0040200

Structure of 951626-95-2

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General Information

  • CAS No. 951626-95-2
  • Cat. No. CS-0040200
  • Purity ≥97%
  • MDL No. MFCD09832110
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₁N₃O₃
  • Molecular Weight 209.20
  • Synonym(s) PYRAZOLO[1,5-A]PYRAZINE-2-CARBOXYLIC ACID, 4,5,6,7-TETRAHYDRO-4-OXO-, ETHYL ESTER
  • SMILES O=C(C1=NN2C(C(NCC2)=O)=C1)OCC

Synthesis

  • Route1
    • null|null
      1380507-24-3
    • ~76%
    • In-stock
      Ethyl 4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate|CS-0040200
      951626-95-2

    References

    • VANDERBILT UNIVERSITY; CONN, P., Jeffrey; LINDSLEY, Craig, W.; STAUFFER, Shaun, R.; BARTOLOMÉ-NEBREDA, José Manuel; CONDE-CEIDE, Susana; MACDONALD, Gregor, James; TONG, Han Min; ALCÁZAR-VACA, Manuel Jesús; ANDRÉS-GIL, José Ignacio Patent: WO2013/192350 A1, 2013 ; Location in patent: Paragraph 00591 ;
  • Route2

    References

    • VANDERBILT UNIVERSITY; CONN, P., Jeffrey; LINDSLEY, Craig, W.; STAUFFER, Shaun, R.; JONES, Carrie, K.; CONDE-CEIDE, Susana; TONG, Han Min; BARTOLOME-NEBREDA, Jose, Manuel; MACDONALD, Gregor, James Patent: WO2012/78817 A1, 2012 ; WO 2012/078817 A1

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   73.22
  • LogP   -0.1968
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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