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CS-W001157 4
Total: USD 88.00

2,3,5,6-Tetramethylbenzenesulfonic acid

  • CAS No. 4681-78-1

  • Cat. No. CS-0332119
  • Molecule weight214.28
  • Purity≥98%
  • MDL No.None

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

2,3,5,6-Tetramethylbenzenesulfonic acid|CS-0332119

Structure of 4681-78-1

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General Information

  • CAS No. 4681-78-1
  • Cat. No. CS-0332119
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₄O₃S
  • Molecular Weight 214.28
  • Synonym(s) aminodurene
  • SMILES CC1=CC(=C(C)C(=C1C)S(=O)(=O)O)C

Synthesis

  • Route1
    • null|null
      95-93-2
    • ~%
    • 2,3,5,6-Tetramethylbenzenesulfonic acid|CS-0332119
      4681-78-1

    References

    • Smith; Cass Journal of the American Chemical Society, 1932 , vol. 54, p. 1609,1611
  • Route2
    • null|null
      81212-00-2
    • ~99%
    • 2,3,5,6-Tetramethylbenzenesulfonic acid|CS-0332119
      4681-78-1

    References

    • Koeberg-Telder, Ankie; Cerfontain, Hans Recueil: Journal of the Royal Netherlands Chemical Society, 1982 , vol. 101, # 1 p. 41 - 47

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   54.37
  • LogP   2.16698
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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