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CS-W001157 4
Total: USD 88.00

Cyclohexyl 4-methylbenzenesulfonate

  • CAS No. 953-91-3

  • Cat. No. CS-0153018
  • Molecule weight254.35
  • Purity≥98%
  • MDL No.MFCD00014291

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

Cyclohexyl 4-methylbenzenesulfonate|CS-0153018

Structure of 953-91-3

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General Information

  • CAS No. 953-91-3
  • Cat. No. CS-0153018
  • Purity ≥98%
  • MDL No. MFCD00014291
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₈O₃S
  • Molecular Weight 254.35
  • Synonym(s) p-Toluenesulfonic Acid Cyclohexyl Ester
  • SMILES CC1=CC=C(C=C1)S(=O)(=O)OC2CCCCC2

Synthesis

  • Route1
    • null|null
      98-59-9
    • In-stock
      1-Cyclohexanol|CS-0017198
      108-93-0
    • ~97%
    • In-stock
      Cyclohexyl 4-methylbenzenesulfonate|CS-0153018
      953-91-3

    References

    • Sagami Chemical Research Center; Kaken Pharmaceutical Co., Ltd. Patent: US5639915 A1, 1997 ;
  • Route2
    • null|null
      104-15-4
    • In-stock
      1-Cyclohexanol|CS-0017198
      108-93-0
    • ~96%
    • In-stock
      Cyclohexyl 4-methylbenzenesulfonate|CS-0153018
      953-91-3

    References

    • Das, Biswanath; Reddy, V. Saidi; Reddy, M. Ravinder Tetrahedron Letters, 2004 , vol. 45, # 36 p. 6717 - 6719
  • Route3

    References

    • Journal of Sulfur Chemistry, , vol. 34, # 4 p. 347 - 357

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   43.37
  • LogP   3.03302
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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