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CS-W001157 4
Total: USD 88.00

6-nitrobenzo[d]thiazole-2-carbonitrile

  • CAS No. 188672-83-5

  • Cat. No. CS-0005602
  • Purity≥98%
  • MDL No.MFCD18813190

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

6-nitrobenzo[d]thiazole-2-carbonitrile|CS-0005602

Structure of 188672-83-5

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General Information

  • CAS No. 188672-83-5
  • Cat. No. CS-0005602
  • Purity ≥98%
  • MDL No. MFCD18813190
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₃N₃O₂S
  • Molecular Weight 205.19
  • Synonym(s) 6-Nitrobenzothiazole-2-carbonitrile
  • SMILES N#CC1=NC2=CC=C([N+]([O-])=O)C=C2S1

Synthesis

  • Route1
    • null|null
      1048367-35-6
    • ~77%
    • In-stock
      6-nitrobenzo[d]thiazole-2-carbonitrile|CS-0005602
      188672-83-5

    References

    • Frere, Stephane; Thiery, Valerie; Bailly, Christian; Besson, Thierry Tetrahedron, 2003 , vol. 59, # 6 p. 773 - 779
  • Route2

    References

    • GRYSHUK, Amy L.; Perkins, Julie; LaTour, John V. Patent: US2011/224442 A1, 2011 ; Location in patent: Page/Page column 13 ;
  • Route3

    References

    • Frere, Stephane; Thiery, Valerie; Bailly, Christian; Besson, Thierry Tetrahedron, 2003 , vol. 59, # 6 p. 773 - 779

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

Quality Control

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Computational Chemistry Data

  • TPSA   79.82
  • LogP   2.07618
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   1

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