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CS-W001157 4
Total: USD 88.00

1-(Methylsulfanyl)-3-nitrobenzene

  • CAS No. 2524-76-7

  • Cat. No. CS-0206996
  • Purity≥98%
  • MDL No.MFCD00024501

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

1-(Methylsulfanyl)-3-nitrobenzene|CS-0206996

Structure of 2524-76-7

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General Information

  • CAS No. 2524-76-7
  • Cat. No. CS-0206996
  • Purity ≥98%
  • MDL No. MFCD00024501
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇NO₂S
  • Molecular Weight None
  • Synonym(s) 3-Nitrothioanisole
  • SMILES CSC1=CC=CC(=C1)[N+](=O)[O-]

Synthesis

  • Route1
    • null|null
      13511-86-9
    • null|null
      77-78-1
    • ~91%
    • In-stock
      1-(Methylsulfanyl)-3-nitrobenzene|CS-0206996
      2524-76-7

    References

    • Auckland Uniservices Limited Patent: EP1468688 A2, 2004 ; Location in patent: Page/Page column 24; 46 ;
  • Route2
    • null|null
      624-92-0
    • null|null
      99-09-2
    • ~58%
    • In-stock
      1-(Methylsulfanyl)-3-nitrobenzene|CS-0206996
      2524-76-7

    References

    • Majek, Michal; Von Wangelin, Axel Jacobi Chemical Communications, 2013 , vol. 49, # 48 p. 5507 - 5509
  • Route3
    • null|null
      99-65-0
    • null|null
      3908-55-2
    • ~20%
    • In-stock
      1-(Methylsulfanyl)-3-nitrobenzene|CS-0206996
      2524-76-7

    References

    • Qiao, Qi; Dominique, Romyr; Sidduri, Achyutharao; Lou, Jianping; Goodnow, Robert A. Synthetic Communications, 2010 , vol. 40, # 24 p. 3691 - 3698

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-H317
Precautionary Statements : P261-P264-P270-P272-P280-P302+P352-P330-P363-P501-P301+P312-P333+P313

Quality Control

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Computational Chemistry Data

  • TPSA   43.14
  • LogP   2.3167
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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