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CS-W001157 4
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1-((4-Chlorophenyl)sulfonyl)propan-2-one

  • CAS No. 5000-48-6

  • Cat. No. CS-0314761
  • Purity95+%
  • MDL No.None

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

1-((4-Chlorophenyl)sulfonyl)propan-2-one|CS-0314761

Structure of 5000-48-6

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General Information

  • CAS No. 5000-48-6
  • Cat. No. CS-0314761
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉ClO₃S
  • Molecular Weight 232.68
  • Synonym(s) 4-Chlorophenylsulfonylacetone
  • SMILES CC(=O)CS(=O)(=O)C1=CC=C(C=C1)Cl

Synthesis

  • Route1

    References

    • Xie; Chen Synthetic Communications, 2001 , vol. 31, # 20 p. 3145 - 3149
  • Route2

    References

    • Pokhodylo, Nazariy T.; Matiychuk, Vasyl S.; Obushak, Mykola D. Synthesis, 2009 , # 14 art. no. Z03509SS, p. 2321 - 2323
  • Route3
    • null|null
      78-95-5
    • ~%
    • 1-((4-Chlorophenyl)sulfonyl)propan-2-one|CS-0314761
      5000-48-6

    References

    • Troeger; Mueller Archiv der Pharmazie (Weinheim, Germany), 1914 , vol. 252, p. 45

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-H332-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   51.21
  • LogP   1.7027
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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