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CS-W001157 4
Total: USD 88.00

N4-Acetylsulfamethoxazole Sulfamethoxazole Impurity

  • CAS No. 21312-10-7

  • Cat. No. CS-0229024
  • Purity≥98%
  • MDL No.MFCD00205417

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

N4-Acetylsulfamethoxazole Sulfamethoxazole  Impurity|CS-0229024

Structure of 21312-10-7

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General Information

  • CAS No. 21312-10-7
  • Cat. No. CS-0229024
  • Purity ≥98%
  • MDL No. MFCD00205417
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₃N₃O₄S
  • Molecular Weight 295.32
  • Synonym(s) N-Acetyl Sulfamethoxazole;N4-Acetylsulfamethoxazole
  • SMILES CC(NC1=CC=C(C=C1)S(=O)(NC2=NOC(C)=C2)=O)=O

Synthesis

  • Route1

    References

    • Brimacombe, Kyle R.; Walsh, Martin J.; Liu, Li; Vasquez-Valdivieso, Montserrat G.; Morgan, Hugh P.; McNae, Iain; Fothergill-Gilmore, Linda A.; Michels, Paul A. M.; Auld, Douglas S.; Simeonov, Anton; Walkinshaw, Malcolm D.; Shen, Min; Boxer, Matthew B. ACS Medicinal Chemistry Letters, 2014 , vol. 5, # 1 p. 12 - 17
  • Route2
    • In-stock
      Sulfamethoxazole 1000 µg/mL in methanol|CS-0835986
      723-46-6
    • null|null
      75-36-5
    • ~71%
    • In-stock
      N4-Acetylsulfamethoxazole Sulfamethoxazole  Impurity|CS-0229024
      21312-10-7

    References

    • Wang, Gong-Bao; Wang, Lin-Fa; Li, Chao-Zhang; Sun, Jing; Zhou, Guang-Ming; Yang, Da-Cheng Research on Chemical Intermediates, 2012 , vol. 38, # 1 p. 77 - 89
  • Route3

    References

    • Chemical and Pharmaceutical Bulletin, , vol. 10, p. 572 - 575

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

Quality Control

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Computational Chemistry Data

  • TPSA   101.3
  • LogP   1.74222
  • H_Acceptors   5
  • H_Donors   2
  • Rotatable_Bonds   4

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