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CS-W001157 4
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tert-Butyl 5-cyano-3-formyl-1H-indole-1-carboxylate

  • CAS No. 914348-93-9

  • Cat. No. CS-W023017
  • Purity≥95%
  • MDL No.MFCD05864692

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

tert-Butyl 5-cyano-3-formyl-1H-indole-1-carboxylate|CS-W023017

Structure of 914348-93-9

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General Information

  • CAS No. 914348-93-9
  • Cat. No. CS-W023017
  • Purity ≥95%
  • MDL No. MFCD05864692
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₄N₂O₃
  • Molecular Weight 270.28
  • Synonym(s) 1-Boc-5-Cyano-3-formylindole
  • SMILES C(=O)(OC(C)(C)C)[N]2C1=CC=C(C=C1C(=C2)C=O)C#N

Synthesis

  • Route1

    References

    • KATHOLIEKE UNIVERSITEIT LEUVEN; BARDIOT, Dorothée; CARLENS, Gunter; DALLMEIER, Kai; KAPTEIN, Suzanne; McNAUGHTON, Michael; MARCHAND, Arnaud; NEYTS, Johan; SMETS, Wim Patent: WO2013/45516 A1, 2013 ; Location in patent: Page/Page column 129; 179 ;

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

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Computational Chemistry Data

  • TPSA   72.09
  • LogP   3.10868
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   1

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