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CS-W001157 4
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5-Isopropylisoxazol-3-amine

  • CAS No. 55809-38-6

  • Cat. No. CS-0163648
  • Purity≥97%
  • MDL No.MFCD18379725

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

5-Isopropylisoxazol-3-amine|CS-0163648

Structure of 55809-38-6

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General Information

  • CAS No. 55809-38-6
  • Cat. No. CS-0163648
  • Purity ≥97%
  • MDL No. MFCD18379725
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₀N₂O
  • Molecular Weight 126.16
  • Synonym(s) 5-(Propan-2-yl)-1,2-oxazol-3-amine
  • SMILES NC1=NOC(C(C)C)=C1

Synthesis

  • Route1

    References

    • Johnson, Leland; Powers, James; Ma, Fupeng; Jendza, Keith; Wang, Bing; Meredith, Erik; Mainolfi, Nello Synthesis (Germany), 2013 , vol. 45, # 2 p. 171 - 173
  • Route2
    • null|null
      1188908-78-2
    • ~%
    • 5-Isopropylisoxazol-3-amine|CS-0163648
      55809-38-6

    References

    • Rowbottom, Martin W.; Faraoni, Raffaella; Chao, Qi; Campbell, Brian T.; Lai, Andiliy G.; Setti, Eduardo; Ezawa, Maiko; Sprankle, Kelly G.; Abraham, Sunny; Tran, Lan; Struss, Brian; Gibney, Michael; Armstrong, Robert C.; Gunawardane, Ruwanthi N.; Nepomuceno, Ronald R.; Valenta, Ianina; Hua, Helen; Gardner, Michael F.; Cramer, Merryl D.; Gitnick, Dana; Insko, Darren E.; Apuy, Julius L.; Jones-Bolin, Susan; Ghose, Arup K.; Herbertz, Torsten; Ator, Mark A.; Dorsey, Bruce D.; Ruggeri, Bruce; Williams, Michael; Bhagwat, Shripad; James, Joyce; Holladay, Mark W. Journal of Medicinal Chemistry, 2012 , vol. 55, # 3 p. 1082 - 1105
  • Route3
    • null|null
      1188908-77-1
    • ~%
    • 5-Isopropylisoxazol-3-amine|CS-0163648
      55809-38-6

    References

    • Rowbottom, Martin W.; Faraoni, Raffaella; Chao, Qi; Campbell, Brian T.; Lai, Andiliy G.; Setti, Eduardo; Ezawa, Maiko; Sprankle, Kelly G.; Abraham, Sunny; Tran, Lan; Struss, Brian; Gibney, Michael; Armstrong, Robert C.; Gunawardane, Ruwanthi N.; Nepomuceno, Ronald R.; Valenta, Ianina; Hua, Helen; Gardner, Michael F.; Cramer, Merryl D.; Gitnick, Dana; Insko, Darren E.; Apuy, Julius L.; Jones-Bolin, Susan; Ghose, Arup K.; Herbertz, Torsten; Ator, Mark A.; Dorsey, Bruce D.; Ruggeri, Bruce; Williams, Michael; Bhagwat, Shripad; James, Joyce; Holladay, Mark W. Journal of Medicinal Chemistry, 2012 , vol. 55, # 3 p. 1082 - 1105

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H303-H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   52.05
  • LogP   1.3802
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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