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CS-W001157 4
Total: USD 88.00

1-((2R,3R,4S,5R)-3,4-Dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione Molnupiravir Impurity

  • CAS No. 58-96-8

  • Cat. No. CS-0616057
  • Purity≥98%
  • MDL No.MFCD00006526

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

1-((2R,3R,4S,5R)-3,4-Dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione Molnupiravir Impurity|CS-0616057

Structure of 58-96-8

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General Information

  • CAS No. 58-96-8
  • Cat. No. CS-0616057
  • Purity ≥98%
  • MDL No. MFCD00006526
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₂N₂O₆
  • Molecular Weight 244.20
  • Synonym(s) None
  • SMILES O[C@H]1[C@@H](O)[C@H](N2C(NC(C=C2)=O)=O)O[C@@H]1CO

Synthesis

  • Route1

    References

    • Golden, Kathryn C.; Gregg, Brian T.; Quinn, John F. Tetrahedron Letters, 2010 , vol. 51, # 31 p. 4010 - 4013
  • Route2
    • 1-((2R,3R,4S,5R)-3,4-dihydroxy-5-((trityloxy)methyl)tetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione|CS-0454578
      6554-10-5
    • ~95%
    • 1-((2R,3R,4S,5R)-3,4-Dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione Molnupiravir Impurity|CS-0616057
      58-96-8

    References

    • Hwu, Jih Ru; Jain, Moti L.; Tsai, Fu-Yuan; Tsay, Shwu-Chen; Balakumar, Arumugham; Hakimelahi, Gholam H. Journal of Organic Chemistry, 2000 , vol. 65, # 17 p. 5077 - 5088
  • Route3

    References

    • Meier, Lidiane; Monteiro, Gustavo C.; Baldissera, Rodrigo A.M.; Sa, Marcus Mandolesi Journal of the Brazilian Chemical Society, 2010 , vol. 21, # 5 p. 859 - 866

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

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Computational Chemistry Data

  • TPSA   124.78
  • LogP   -2.8519
  • H_Acceptors   7
  • H_Donors   4
  • Rotatable_Bonds   2

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