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CS-W001157 4
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3-(3-(Methylthio)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)propanoic acid

  • CAS No. 100524-19-4

  • Cat. No. CS-0509962
  • Purity≥98%
  • MDL No.None

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

3-(3-(Methylthio)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl)propanoic acid|CS-0509962

Structure of 100524-19-4

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General Information

  • CAS No. 100524-19-4
  • Cat. No. CS-0509962
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₉N₃O₃S
  • Molecular Weight 215.23
  • Synonym(s) 3-(2,5-Dihydro-3-methylthio-5-oxo-1,2,4-triazin-6-yl)propionic acid
  • SMILES O=C(O)CCC1=NNC(SC)=NC1=O

Synthesis

  • Route1

    References

    • Journal fuer Praktische Chemie (Leipzig), , vol. 329, # 2 p. 290 - 300

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+P364-P405-P501

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Computational Chemistry Data

  • TPSA   95.94
  • LogP   -0.096
  • H_Acceptors   5
  • H_Donors   2
  • Rotatable_Bonds   4

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