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Ethyl 2-(3-methylthioureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate

  • CAS No. 51486-13-6

  • Cat. No. CS-0314747
  • Molecule weight298.42
  • Purity≥97%
  • MDL No.None

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

Ethyl 2-(3-methylthioureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate|CS-0314747

Structure of 51486-13-6

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General Information

  • CAS No. 51486-13-6
  • Cat. No. CS-0314747
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₈N₂O₂S₂
  • Molecular Weight 298.42
  • Synonym(s) Benzo(b)thiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-(((methylamino)thioxomethyl)amino)-, ethyl ester
  • SMILES CCOC(C1=C(SC2=C1CCCC2)NC(NC)=S)=O

Synthesis

  • Route1

    References

    • Talukdar, P. D.; Sengupta, S. K.; Datta, A. K. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1981 , vol. 20, # 7 p. 538 - 542

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   50.36
  • LogP   2.7198
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   3

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