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CS-W001157 4
Total: USD 88.00

6-ethoxy-3H-1,3-benzothiazol-2-one

  • CAS No. 72680-01-4

  • Cat. No. CS-0061658
  • Molecule weight195.24
  • Purity≥97%
  • MDL No.None

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

6-ethoxy-3H-1,3-benzothiazol-2-one|CS-0061658

Structure of 72680-01-4

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General Information

  • CAS No. 72680-01-4
  • Cat. No. CS-0061658
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉NO₂S
  • Molecular Weight 195.24
  • Synonym(s) 6-Ethoxy-2(3H)-benzothiazolone
  • SMILES CCOC1=CC2=C(C=C1)N=C(O)S2

Synthesis

  • Route1
    • 2-Amino-5-ethoxybenzenethiol|CS-0581526
      34250-61-8
    • null|null
      530-62-1
    • ~%
    • 6-ethoxy-3H-1,3-benzothiazol-2-one|CS-0061658
      72680-01-4

    References

    • US4328235 A1, ;
  • Route2

    References

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

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

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Computational Chemistry Data

  • TPSA   42.35
  • LogP   2.4006
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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