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CS-W001157 4
Total: USD 88.00

Benzyl(2-nitrophenyl)sulfane

  • CAS No. 22057-44-9

  • Cat. No. CS-0336375
  • Purity95+%
  • MDL No.None

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

Benzyl(2-nitrophenyl)sulfane|CS-0336375

Structure of 22057-44-9

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General Information

  • CAS No. 22057-44-9
  • Cat. No. CS-0336375
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₁NO₂S
  • Molecular Weight 245.30
  • Synonym(s) 1-(Benzylsulfanyl)-2-nitrobenzene
  • SMILES C1=CC=C(C=C1)CSC2=CC=CC=C2[N+](=O)[O-]

Synthesis

  • Route1
    • null|null
      88-73-3
    • null|null
      100-53-8
    • ~91%
    • Benzyl(2-nitrophenyl)sulfane|CS-0336375
      22057-44-9

    References

    • Li, Zai-Shun; Wang, Wei-Min; Lu, Wei; Niu, Cong-Wei; Li, Yong-Hong; Li, Zheng-Ming; Wang, Jian-Guo Bioorganic and Medicinal Chemistry Letters, 2013 , vol. 23, # 13 p. 3723 - 3727
  • Route2

    References

    • Gogoi, Prasanta; Kalita, Mukul; Barman, Pranjit Synlett, 2014 , vol. 25, # 6 art. no. 47, p. 866 - 870
  • Route3

    References

    • Martinek, Marek; Korf, Michal; Srogl, Jiri Chemical Communications, 2010 , vol. 46, # 24 p. 4387 - 4389

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   43.14
  • LogP   3.8871
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   4

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