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CS-W001157 4
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Ethyl 2-bromo-4,5,6,7-tetrahydrobenzo[d]thiazole-4-carboxylate

  • CAS No. 729590-69-6

  • Cat. No. CS-0095969
  • Purity≥97%
  • MDL No.MFCD22565626

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

Ethyl 2-bromo-4,5,6,7-tetrahydrobenzo[d]thiazole-4-carboxylate|CS-0095969

Structure of 729590-69-6

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General Information

  • CAS No. 729590-69-6
  • Cat. No. CS-0095969
  • Purity ≥97%
  • MDL No. MFCD22565626
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂BrNO₂S
  • Molecular Weight 290.18
  • Synonym(s) 4-Benzothiazolecarboxylic acid, 2-bromo-4,5,6,7-tetrahydro-, ethyl ester
  • SMILES O=C(C1CCCC2=C1N=C(Br)S2)OCC

Synthesis

  • Route1

    References

    • ELI LILLY AND COMPANY Patent: WO2004/63155 A1, 2004 ; Location in patent: Page 91-92 ; WO 2004/063155 A1

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   39.19
  • LogP   2.8886
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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