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CS-W001157 4
Total: USD 88.00

4-(Methylsulfonyl) phenylacetonitrile

  • CAS No. 25025-07-4

  • Cat. No. CS-0206838
  • Purity≥98%
  • MDL No.MFCD00079775

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

4-(Methylsulfonyl) phenylacetonitrile|CS-0206838

Structure of 25025-07-4

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General Information

  • CAS No. 25025-07-4
  • Cat. No. CS-0206838
  • Purity ≥98%
  • MDL No. MFCD00079775
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉NO₂S
  • Molecular Weight 195.24
  • Synonym(s) 4-(METHYLSULFONYL)PHENYLACETONITRILE
  • SMILES CS(=O)(=O)C1=CC=C(C=C1)CC#N

Synthesis

  • Route1
    • null|null
      374725-45-8
    • ~%
    • 4-(Methylsulfonyl) phenylacetonitrile|CS-0206838
      25025-07-4

    References

    • Journal of the Chemical Society, , p. 1506
  • Route2
    • Benzeneacetic Acid, 4-(methylsulfonyl)-, ethyl ester|CS-0765273
      58058-86-9
    • ~%
    • 4-(Methylsulfonyl) phenylacetonitrile|CS-0206838
      25025-07-4

    References

    • Journal of the Chemical Society, , p. 1506
  • Route3

    References

    • Journal of the Chemical Society, , p. 1506

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H226-H315-H319
Precautionary Statements : P210-P233-P240-P241-P242-P243-P264-P280-P362+P364-P370+P378-P501

Quality Control

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Computational Chemistry Data

  • TPSA   57.93
  • LogP   1.15618
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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