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Ethyl 3-amino-5-(4-bromophenyl)thiophene-2-carboxylate

  • CAS No. 91076-96-9

  • Cat. No. CS-0504483
  • Purity≥95%
  • MDL No.None

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

Ethyl 3-amino-5-(4-bromophenyl)thiophene-2-carboxylate|CS-0504483

Structure of 91076-96-9

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General Information

  • CAS No. 91076-96-9
  • Cat. No. CS-0504483
  • Purity ≥95%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₂BrNO₂S
  • Molecular Weight 326.21
  • Synonym(s) 3-AMINO-5-(4-BROMO-PHENYL)-THIOPHENE-2-CARBOXYLIC ACID ETHYL ESTER
  • SMILES O=C(OCC)C=1SC(=CC1N)C=2C=CC(Br)=CC2

Synthesis

  • Route1
    • 3-(4-Bromophenyl)-3-chloroacrylonitrile|CS-0570610
      78583-87-6
    • null|null
      623-51-8
    • ~%
    • Ethyl 3-amino-5-(4-bromophenyl)thiophene-2-carboxylate|CS-0504483
      91076-96-9

    References

    • Hartmann, Horst; Liebscher, Juergen Synthesis, 1984 , # 3 p. 275 - 276

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

Quality Control

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Computational Chemistry Data

  • TPSA   52.32
  • LogP   3.9365
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   3

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