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CS-W001157 4
Total: USD 88.00

4-(2-Formyl-pyrrol-1-yl)-benzoic acid ethyl ester

  • CAS No. 86454-37-7

  • Cat. No. CS-0206755
  • Purity≥95%
  • MDL No.MFCD02177627

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

4-(2-Formyl-pyrrol-1-yl)-benzoic acid ethyl ester|CS-0206755

Structure of 86454-37-7

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General Information

  • CAS No. 86454-37-7
  • Cat. No. CS-0206755
  • Purity ≥95%
  • MDL No. MFCD02177627
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₃NO₃
  • Molecular Weight 243.26
  • Synonym(s) ethyl 4-(2-formyl-1H-pyrrol-1-yl)benzoate
  • SMILES CCOC(=O)C1=CC=C(C=C1)N2C=CC=C2C=O

Synthesis

  • Route1

    References

    • Pina, M. del' K.; Budylin, V. A.; Rodriges, M.; Terent'ev, P. B.; Bundel', Yu. G. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1989 , vol. 25, # 2 p. 142 - 146 Khimiya Geterotsiklicheskikh Soedinenii, 1989 , vol. 25, # 2 p. 180 - 184

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
Precautionary Statements : P264-P270-P330-P501

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Computational Chemistry Data

  • TPSA   48.3
  • LogP   2.4665
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   4

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