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CS-W001157 4
Total: USD 88.00

3-Sulfobenzoic acid

  • CAS No. 121-53-9

  • Cat. No. CS-0529664
  • Molecule weight202.18
  • Purity≥98%
  • MDL No.None

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

3-Sulfobenzoic acid|CS-0529664

Structure of 121-53-9

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General Information

  • CAS No. 121-53-9
  • Cat. No. CS-0529664
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₆O₅S
  • Molecular Weight 202.18
  • Synonym(s) None
  • SMILES O=C(O)C1=CC=CC(S(=O)(O)=O)=C1

Synthesis

  • Route1

    References

    • Hoechst AG Patent: US5387711 A1, 1995 ;
  • Route2
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      98-88-4
    • ~%
    • 3-Sulfobenzoic acid|CS-0529664
      121-53-9

    References

    • Elliott et al. Journal of the Chemical Society, 1926 , p. 1229
  • Route3

    References

    • Dimroth; v. Schmaedel Chemische Berichte, 1907 , vol. 40, p. 2413

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 3265
Class : 8
Packing Group : Ⅲ
Hazard Statements : H314
Precautionary Statements : P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   91.67
  • LogP   0.6315
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   2

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