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CS-W001157 4
Total: USD 88.00

Methyl 3-(methylsulfonyl)benzoate

  • CAS No. 22821-69-8

  • Cat. No. CS-0205096
  • Purity≥97%
  • MDL No.MFCD11223481

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

Methyl 3-(methylsulfonyl)benzoate|CS-0205096

Structure of 22821-69-8

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General Information

  • CAS No. 22821-69-8
  • Cat. No. CS-0205096
  • Purity ≥97%
  • MDL No. MFCD11223481
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀O₄S
  • Molecular Weight 214.24
  • Synonym(s) Benzoic acid, 3-(methylsulfonyl)-, methyl ester
  • SMILES O=C(OC)C1=CC=CC(=C1)S(=O)(=O)C

Synthesis

  • Route1

    References

    • SUNESIS PHARMACEUTICALS, INC. Patent: WO2005/44817 A1, 2005 ; Location in patent: Page/Page column 91-92 ;
  • Route2

    References

    • ANAYADERM, INC.; MOHAN, Raju Patent: WO2013/130892 A1, 2013 ; Location in patent: Paragraph 00252 ;
  • Route3

    References

    • Collection of Czechoslovak Chemical Communications, , vol. 33, p. 3988 - 3999

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   60.44
  • LogP   0.8767
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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