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CS-W001157 4
Total: USD 88.00

(Methylsulfinyl)benzene

  • CAS No. 1193-82-4

  • Cat. No. CS-0046805
  • Purity≥95%
  • MDL No.None

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

(Methylsulfinyl)benzene|CS-0046805

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General Information

  • CAS No. 1193-82-4
  • Cat. No. CS-0046805
  • Purity ≥95%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₈OS
  • Molecular Weight 140.20
  • Synonym(s) Methyl phenyl sulfoxide
  • SMILES O=S(C1=CC=CC=C1)C

Description

(R)-methyl phenyl sulfoxide is an important pharmaceutical intermediate.Methyl phenyl sulfoxide has been used in the synthesis of:isotopically labelled 1, 3-dithiane, a useful labeled synthonnelfinavir, potent HIV-protease inhibitorsulfoximines and in studies on solvent-water partitioning

Synthesis

  • Route1

    References

    • ALLERGAN, INC. Patent: WO2008/61236 A2, 2008 ; Location in patent: Page/Page column 31-32 ;
  • Route2

    References

    • Ochiai, Masahito; Nakanishi, Akinobu; Ito, Takao Journal of Organic Chemistry, 1997 , vol. 62, # 13 p. 4253 - 4259
  • Route3

    References

    • Synthetic Communications, , vol. 33, # 11 p. 1845 - 1854

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅲ
Hazard Statements : H315-H318-H335
Precautionary Statements : P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P363-P405-P501

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   1.424
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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