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CS-W001157 4
Total: USD 88.00

6-Nitrobenzo[d]thiazol-2(3H)-one

  • CAS No. 28620-12-4

  • Cat. No. CS-W015707
  • Purity≥95%
  • MDL No.MFCD00239350

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

6-Nitrobenzo[d]thiazol-2(3H)-one|CS-W015707

Structure of 28620-12-4

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General Information

  • CAS No. 28620-12-4
  • Cat. No. CS-W015707
  • Purity ≥95%
  • MDL No. MFCD00239350
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₄N₂O₃S
  • Molecular Weight 196.18
  • Synonym(s) 6-nitro-1,3-benzothiazol-2(3H)-one
  • SMILES O=C1SC2=CC([N+]([O-])=O)=CC=C2N1

Synthesis

  • Route1

    References

    • D'Amico, John J.; Bollinger, Frederic G.; Freeman, John J. Journal of Heterocyclic Chemistry, 1988 , vol. 25, p. 1503 - 1509
  • Route2

    References

    • Gallagher, Peter T.; Iddon, Brian; Suschitzky, Hans Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1980 , p. 2358 - 2361
  • Route3
    • null|null
      1131-75-5
    • ~31%
    • 6-Nitrobenzo[d]thiazol-2(3H)-one|CS-W015707
      28620-12-4

    References

    • Gallagher, Peter T.; Iddon, Brian; Suschitzky, Hans Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1980 , p. 2358 - 2361

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362-P405-P501

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Computational Chemistry Data

  • TPSA   76
  • LogP   1.4978
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   1

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