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CS-W001157 4
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Ethyl 4-chloro-1H-indole-2-carboxylate

  • CAS No. 53590-46-8

  • Cat. No. CS-0103612
  • Purity≥98%
  • MDL No.MFCD09264531

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

Ethyl 4-chloro-1H-indole-2-carboxylate|CS-0103612

Structure of 53590-46-8

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General Information

  • CAS No. 53590-46-8
  • Cat. No. CS-0103612
  • Purity ≥98%
  • MDL No. MFCD09264531
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₀ClNO₂
  • Molecular Weight 223.66
  • Synonym(s) Ethyl-4-Chloroindole-2-Carboxylate
  • SMILES O=C(C(N1)=CC2=C1C=CC=C2Cl)OCC

Synthesis

  • Route1

    References

    • Sanz, Roberto; Escribano, Jaime; Pedrosa, Maria R.; Aguado, Rafael; Arnaiz, Francisco J. Advanced Synthesis and Catalysis, 2007 , vol. 349, # 4-5 p. 713 - 718
  • Route2
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      Ethyl 4-chloro-1H-indole-2-carboxylate|CS-0103612
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    References

    • EP1147110 B1, ; EP 1147110 B1
  • Route3

    References

    • Sudhakara; Jayadevappa; Mahadevan; Hulikal, Vijaykumar Synthetic Communications, 2009 , vol. 39, # 14 p. 2506 - 2515

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

Quality Control

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Computational Chemistry Data

  • TPSA   42.09
  • LogP   2.998
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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