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CS-W001157 4
Total: USD 88.00

3-Oxo-3,4-dihydro-2H-benzo[b][1,4]thiazine-6-carbaldehyde

  • CAS No. 262426-58-4

  • Cat. No. CS-0100695
  • Molecule weight193.22
  • Purity≥98%
  • MDL No.None

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

3-Oxo-3,4-dihydro-2H-benzo[b][1,4]thiazine-6-carbaldehyde|CS-0100695

Structure of 262426-58-4

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General Information

  • CAS No. 262426-58-4
  • Cat. No. CS-0100695
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇NO₂S
  • Molecular Weight 193.22
  • Synonym(s) 3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxaldehyde
  • SMILES O=CC1=CC=C(SCC(N2)=O)C2=C1

Synthesis

  • Route1
    • 6-(Hydroxymethyl)-2H-benzo[b][1,4]thiazin-3(4H)-one|CS-0452599
      443955-31-5
    • ~56%
    • 3-Oxo-3,4-dihydro-2H-benzo[b][1,4]thiazine-6-carbaldehyde|CS-0100695
      262426-58-4

    References

    • Allison, Brett D.; Gomez, Laurent; Grice, Cheryl A.; Hack, Michael D.; Morrow, Brian J.; Motley, S. Timothy; Santillan, Alejandro; Shaw, Karen J.; Schwarz, Kimberly L.; Tang, Liu Y.; Venkatesan, Hariharan; Wiener, John J. M. Patent: US2006/223810 A1, 2006 ; Location in patent: Page/Page column 22 ;
  • Route2
    • null|null
      262426-54-0
    • ~%
    • 3-Oxo-3,4-dihydro-2H-benzo[b][1,4]thiazine-6-carbaldehyde|CS-0100695
      262426-58-4

    References

    • Morphochem Aktiengesellschaft Fur Kombinatorische Chemie Patent: US2010/324030 A1, 2010 ; Location in patent: Page/Page column 12 ;
  • Route3
    • null|null
      262426-52-8
    • ~52%
    • 3-Oxo-3,4-dihydro-2H-benzo[b][1,4]thiazine-6-carbaldehyde|CS-0100695
      262426-58-4

    References

    • Giannopoulos, Thomas; Ferguson, John R.; Wakefield, Basil J.; Varvounis, George Tetrahedron, 2000 , vol. 56, # 3 p. 447 - 453

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
Precautionary Statements : P264-P270-P330-P501

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Computational Chemistry Data

  • TPSA   46.17
  • LogP   1.5433
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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