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CS-W001157 4
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Di-2-pyridyl thionocarbonate

  • CAS No. 96989-50-3

  • Cat. No. CS-0128326
  • Purity≥97%
  • MDL No.MFCD00074870

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

Di-2-pyridyl thionocarbonate|CS-0128326

Structure of 96989-50-3

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General Information

  • CAS No. 96989-50-3
  • Cat. No. CS-0128326
  • Purity ≥97%
  • MDL No. MFCD00074870
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₈N₂O₂S
  • Molecular Weight 232.26
  • Synonym(s) Thiocarbonic Acid O,O'-Di-2-pyridyl Ester
  • SMILES S=C(OC1=NC=CC=C1)OC2=NC=CC=C2

Description

Di-2-pyridyl thionocarbonate (DPT) was used in the synthesis of 10-des(carbamoyloxy)-10-isothiocyanatoporfiromycin. It was also used as a substitute of thiophosgene, a highly toxic agent, in the preparation of isothiocyanate.

Synthesis

  • Route1
    • α-Pyridone Levetiracetam Impurity|CS-0213990
      142-08-5
    • null|null
      463-71-8
    • ~83%
    • In-stock
      Di-2-pyridyl thionocarbonate|CS-0128326
      96989-50-3

    References

    • Kim, Sunggak; Yi, Kyu Yang Tetrahedron Letters, 1985 , vol. 26, # 13 p. 1661 - 1664
  • Route2
    • 1-Butyl-3-phenylthiourea|CS-0297697
      6336-01-2
    • ~%
    • In-stock
      Di-2-pyridyl thionocarbonate|CS-0128326
      96989-50-3

    References

    • Tetrahedron Letters, , vol. 26, # 13 p. 1661 - 1664

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

Quality Control

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Computational Chemistry Data

  • TPSA   44.24
  • LogP   2.2193
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   2

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