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CS-W001157 4
Total: USD 88.00

Ethyl 4-nitro-1H-indole-2-carboxylate

  • CAS No. 4993-93-5

  • Cat. No. CS-0453049
  • Purity≥98%
  • MDL No.None

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

Ethyl 4-nitro-1H-indole-2-carboxylate|CS-0453049

Structure of 4993-93-5

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General Information

  • CAS No. 4993-93-5
  • Cat. No. CS-0453049
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₀N₂O₄
  • Molecular Weight 234.21
  • Synonym(s) ETHYL 4-NITROINDOLE-2-CARBOXYLATE
  • SMILES CCOC(=O)C1=CC2=C(C=CC=C2[N+](=O)[O-])N1

Synthesis

  • Route1

    References

    • Parmerter et al. Journal of the American Chemical Society, 1958 , vol. 80, p. 4621
  • Route2
    • null|null
      1388183-69-4
    • ~94%
    • Ethyl 4-nitro-1H-indole-2-carboxylate|CS-0453049
      4993-93-5

    References

    • Bujok, Robert; Wrbel, Zbigniew; Wojciechowski, Krzysztof Synlett, 2012 , vol. 23, # 9 p. 1315 - 1320
  • Route3

    References

    • Hadida Ruah, Sara S.; Grootenhuis, Peter D.J.; Van Goor, Frederick; Zhou, Jinglan; Bear, Brian; Miller, Mark T.; McCartney, Jason; Numa, Mehdi Michel Jamel Patent: US2007/244159 A1, 2007 ; Location in patent: Page/Page column 139 ;

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   85.23
  • LogP   2.2528
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   3

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