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CS-W001157 4
Total: USD 88.00

Methyl 6-nitro-1H-indole-2-carboxylate

  • CAS No. 136818-66-1

  • Cat. No. CS-0188105
  • Purity≥96%
  • MDL No.None

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

Methyl 6-nitro-1H-indole-2-carboxylate|CS-0188105

Structure of 136818-66-1

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General Information

  • CAS No. 136818-66-1
  • Cat. No. CS-0188105
  • Purity ≥96%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈N₂O₄
  • Molecular Weight 220.18
  • Synonym(s) 6-NITRO-1H-INDOLE-2-CARBOXYLIC ACID METHYL ESTER
  • SMILES COC(=O)C1=CC2=C(C=C(C=C2)[N+](=O)[O-])N1

Synthesis

  • Route1
    • Methyl6-nitroindoline-2-carboxylate|CS-0172511
      428861-43-2
    • ~96%
    • In-stock
      Methyl 6-nitro-1H-indole-2-carboxylate|CS-0188105
      136818-66-1

    References

    • Lavrenov, Sergei N.; Lakatosh, Sergei A.; Lysenkova, Ludmila N.; Korolev, Alexander M.; Preobrazhenskaya, Maria N. Synthesis, 2002 , # 3 p. 320 - 322
  • Route2
    • null|null
      67-56-1
    • In-stock
      6-Nitro-1H-indole-2-carboxylic acid|CS-0100036
      10242-00-9
    • ~81%
    • In-stock
      Methyl 6-nitro-1H-indole-2-carboxylate|CS-0188105
      136818-66-1

    References

    • SMITHKLINE BEECHAM CORPORATION Patent: WO2008/154271 A1, 2008 ; Location in patent: Page/Page column 133 ;
  • Route3
    • null|null
      67-56-1
    • null|null
      16851-56-2
    • ~56%
    • In-stock
      Methyl 6-nitro-1H-indole-2-carboxylate|CS-0188105
      136818-66-1

    References

    • Botyanszki, Janos; Shi, Dong-Fang; Roberts, Christopher Don; Gezginci, Mikail Hakan; Valdez, Stephen Corey; Sattarzadeh, Sherwin Patent: US2004/63645 A1, 2004 ; Location in patent: Page/Page column 35; 52 ;

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-P280-P302+P352

Quality Control

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Computational Chemistry Data

  • TPSA   85.23
  • LogP   1.8627
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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