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CS-W001157 4
Total: USD 88.00

3-(Methylthio)propyl 4-methylbenzenesulfonate

  • CAS No. 187722-18-5

  • Cat. No. CS-M1208
  • Molecule weight260.37
  • Purity≥98%
  • MDL No.MFCD09841016

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

3-(Methylthio)propyl 4-methylbenzenesulfonate|CS-M1208

Structure of 187722-18-5

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General Information

  • CAS No. 187722-18-5
  • Cat. No. CS-M1208
  • Purity ≥98%
  • MDL No. MFCD09841016
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₆O₃S₂
  • Molecular Weight 260.37
  • Synonym(s) Toluene-4-sulfonic acid 3-methylsulfanyl-propyl ester
  • SMILES O=S(C(C=C1)=CC=C1C)(OCCCSC)=O

Synthesis

  • Route1

    References

    • Synthesis, , # 3 p. 351 - 355
  • Route2

    References

    • WO2006/46031 A1, ; Page/Page column 79-80 ; WO 2006/046031 A1

Safety Information

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GHS Pictogram : N/A
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UN#: N/A
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Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   43.37
  • LogP   2.45342
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   6

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