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CS-W001157 4
Total: USD 88.00

3-(3-Oxo-3,4-dihydro-2h-1,4-benzothiazin-4-yl)propanoic acid

  • CAS No. 37012-79-6

  • Cat. No. CS-0234031
  • Molecule weight237.27
  • Purity≥97%
  • MDL No.None

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

3-(3-Oxo-3,4-dihydro-2h-1,4-benzothiazin-4-yl)propanoic acid|CS-0234031

Structure of 37012-79-6

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General Information

  • CAS No. 37012-79-6
  • Cat. No. CS-0234031
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₁NO₃S
  • Molecular Weight 237.27
  • Synonym(s) 3-(3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl)propanoic acid
  • SMILES O=C(O)CCN1C(CSC2=CC=CC=C12)=O

Synthesis

  • Route1
    • null|null
      134997-77-6
    • ~83%
    • 3-(3-Oxo-3,4-dihydro-2h-1,4-benzothiazin-4-yl)propanoic acid|CS-0234031
      37012-79-6

    References

    • Chande; Suryanarayan Chemistry of Heterocyclic Compounds, 2003 , vol. 39, # 8 p. 1094 - 1098
  • Route2

    References

    • Katekar,G.F. Australian Journal of Chemistry, 1972 , vol. 25, p. 1283 - 1291
  • Route3

    References

    • Chande; Suryanarayan Chemistry of Heterocyclic Compounds, 2003 , vol. 39, # 8 p. 1094 - 1098

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-P305+P351+P338-P330-P362-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   57.61
  • LogP   1.6
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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