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Diethyl 2-aminothiophene-3,4-dicarboxylate

  • CAS No. 104680-25-3

  • Cat. No. CS-0187354
  • Molecule weight243.28
  • Purity≥98%
  • MDL No.None

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

Diethyl 2-aminothiophene-3,4-dicarboxylate|CS-0187354

Structure of 104680-25-3

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General Information

  • CAS No. 104680-25-3
  • Cat. No. CS-0187354
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₃NO₄S
  • Molecular Weight 243.28
  • Synonym(s) 3,4-Diethyl 2-aMinothiophene-3,4-dicarboxylate
  • SMILES CCOC(=O)C1=CSC(=C1C(=O)OCC)N

Synthesis

  • Route1
    • In-stock
      Ethyl pyruvate|CS-0017821
      617-35-6
    • null|null
      105-56-6
    • ~%
    • In-stock
      Diethyl 2-aminothiophene-3,4-dicarboxylate|CS-0187354
      104680-25-3

    References

    • UCB PHARMA S.A.; KATHOLIEKE UNIVERSITEIT LEUVEN, K.U.Leuven RandD; BROOKINGS, Daniel Christopher; FORD, Daniel James; GHAWALKAR, Anant Ramrao; HERMAN, Jean; HUANG, Qiuya; KULISA, Claire Louise; LOUAT, Thierry; NEUSS, Judi Charlotte; REUBERSON, James Thomas; VANDERHOYDONCK, Bart Patent: WO2013/24291 A2, 2013 ; Location in patent: Page/Page column 41; 42 ;

Safety Information

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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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   78.62
  • LogP   1.6837
  • H_Acceptors   6
  • H_Donors   1
  • Rotatable_Bonds   4

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