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CS-W001157 4
Total: USD 88.00

Methyl 4-oxotetrahydro-2H-thiopyran-3-carboxylate

  • CAS No. 4160-61-6

  • Cat. No. CS-W000756
  • Purity≥97%
  • MDL No.MFCD00203485

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

Methyl 4-oxotetrahydro-2H-thiopyran-3-carboxylate|CS-W000756

Structure of 4160-61-6

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General Information

  • CAS No. 4160-61-6
  • Cat. No. CS-W000756
  • Purity ≥97%
  • MDL No. MFCD00203485
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₀O₃S
  • Molecular Weight 174.22
  • Synonym(s) Methyl 4-oxothiane-3-carboxylate
  • SMILES COC(=O)C1CSCCC1=O

Synthesis

  • Route1

    References

    • Ward, Dale E.; Rasheed, M. Abdul; Gillis, H. Martin; Beye, Garrison E.; Jheengut, Vishal; Achonduh, George T. Synthesis, 2007 , # 10 p. 1584 - 1586
  • Route2
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      Methyl 3-mercaptopropanoate|CS-0000049
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    • In-stock
      Methyl 4-oxotetrahydro-2H-thiopyran-3-carboxylate|CS-W000756
      4160-61-6

    References

    • Liu, Hsing-Jang; Ngooi, Teng Ko Canadian Journal of Chemistry, 1982 , vol. 60, p. 437 - 439
  • Route3
    • In-stock
      Dimethyl 3,3-Thiodipropionate|CS-0150683
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      Methyl 4-oxotetrahydro-2H-thiopyran-3-carboxylate|CS-W000756
      4160-61-6
    • null|null
      109276-67-7

    References

    • Paletta, Joseph T.; Pink, Maren; Foley, Bridget; Rajca, Suchada; Rajca, Andrzej Organic Letters, 2012 , vol. 14, # 20 p. 5322 - 5325

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   0.4816
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   1

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