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CS-W001157 4
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3-(Hydroxymethyl)-5-(methylthio)-1,3,4-thiadiazole-2(3H)-thione

  • CAS No. 90567-39-8

  • Cat. No. CS-0316914
  • Purity≥97%
  • MDL No.None

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

3-(Hydroxymethyl)-5-(methylthio)-1,3,4-thiadiazole-2(3H)-thione|CS-0316914

Structure of 90567-39-8

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General Information

  • CAS No. 90567-39-8
  • Cat. No. CS-0316914
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄H₆N₂OS₃
  • Molecular Weight 194.30
  • Synonym(s) 3-hydroxymethyl-5-methylsulfanyl-3H-[1,3,4]thiadiazole-2-thione
  • SMILES CSC1=NN(CO)C(=S)S1

Synthesis

  • Route1
    • null|null
      50-00-0
    • 5-(Methylthio)-1,3,4-thiadiazole-2-thiol|CS-0150089
      6264-40-0
    • ~82%
    • 3-(Hydroxymethyl)-5-(methylthio)-1,3,4-thiadiazole-2(3H)-thione|CS-0316914
      90567-39-8

    References

    • Pappalardo, Sebastiano; Bottino, Francesco; Tringali, Corrado Journal of Organic Chemistry, 1987 , vol. 52, # 3 p. 405 - 412

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+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   38.05
  • LogP   1.34579
  • H_Acceptors   6
  • H_Donors   1
  • Rotatable_Bonds   2

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