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CS-W001157 4
Total: USD 88.00

1-Ethyl-1H-benzoimidazole-2-sulfonic acid

  • CAS No. 90331-19-4

  • Cat. No. CS-0070440
  • Molecule weight226.25
  • Purity≥97%
  • MDL No.MFCD00458807

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

1-Ethyl-1H-benzoimidazole-2-sulfonic acid|CS-0070440

Structure of 90331-19-4

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General Information

  • CAS No. 90331-19-4
  • Cat. No. CS-0070440
  • Purity ≥97%
  • MDL No. MFCD00458807
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀N₂O₃S
  • Molecular Weight 226.25
  • Synonym(s) 1-ethyl-1H-benzimidazole-2-sulfonic acid
  • SMILES O=S(C1=NC2=CC=CC=C2N1CC)(O)=O

Synthesis

  • Route1
    • null|null
      64-67-5
    • 1H-Benzo[d]imidazole-2-sulfonic acid Rabeprazole Impurity|CS-0229640
      40828-54-4
    • ~84%
    • 1-Ethyl-1H-benzoimidazole-2-sulfonic acid|CS-0070440
      90331-19-4

    References

    • Divaeva; Kuzmenko; Morkovnik; Komissarov Chemistry of Heterocyclic Compounds, 2006 , vol. 42, # 4 p. 463 - 468
  • Route2

    References

    • Popov, I. I.; Boroshko, S. L.; Tertov, B. A.; Makarov, S. P.; Simonov, A. M.; Simkin, B. Ya. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1987 , vol. 23, # 12 p. 1348 - 1352 Khimiya Geterotsiklicheskikh Soedinenii, 1987 , # 12 p. 1673 - 1677
  • Route3

    References

    • Popov, I. I.; Boroshko, S. L.; Tertov, B. A.; Makarov, S. P.; Simonov, A. M.; Simkin, B. Ya. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1987 , vol. 23, # 12 p. 1348 - 1352 Khimiya Geterotsiklicheskikh Soedinenii, 1987 , # 12 p. 1673 - 1677

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅱ
Hazard Statements : H302-H314-H335
Precautionary Statements : P260-P264-P270-P271-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P363-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   72.19
  • LogP   1.3029
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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