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CS-W001157 4
Total: USD 88.00

(2,2-Diethoxyethyl)(3-methoxyphenyl)sulfane

  • CAS No. 96803-85-9

  • Cat. No. CS-0001520
  • Purity≥95%
  • MDL No.None

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

(2,2-Diethoxyethyl)(3-methoxyphenyl)sulfane|CS-0001520

Structure of 96803-85-9

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General Information

  • CAS No. 96803-85-9
  • Cat. No. CS-0001520
  • Purity ≥95%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₂₀O₃S
  • Molecular Weight 256.36
  • Synonym(s) 1-(2,2-diethoxyethylsulfanyl)-3-methoxybenzene
  • SMILES COC1=CC(SCC(OCC)OCC)=CC=C1

Synthesis

  • Route1
    • In-stock
      3-Methoxybenzenethiol|CS-0008476
      15570-12-4
    • null|null
      2032-35-1
    • ~99%
    • In-stock
      (2,2-Diethoxyethyl)(3-methoxyphenyl)sulfane|CS-0001520
      96803-85-9

    References

    • N.V. Organon Patent: US2007/112019 A1, 2007 ; Location in patent: Page/Page column 11/1 ;
  • Route2
    • 2-Methoxybenzenethiol, ≥97%|CS-1269041
      7217-59-6
    • null|null
      2032-35-1
    • ~78%
    • In-stock
      (2,2-Diethoxyethyl)(3-methoxyphenyl)sulfane|CS-0001520
      96803-85-9

    References

    • Industry-University Cooperation Foundation Sogang University Patent: US2010/261727 A1, 2010 ; Location in patent: Page/Page column 17 ;
  • Route3

    References

    • He, John Xiaoqiang; Honigschmidt, Nicholas Allan; Kohn, Todd Jonathan; Rocco, Vincent Patrick; Spinazze, Patrick Gianpietro; Takeuchi, Kumiko Patent: US2003/232833 A1, 2003 ; Location in patent: Page 16 ;

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   27.69
  • LogP   3.1864
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   8

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