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CS-W001157 4
Total: USD 88.00

tert-Butyl 3-(cyanomethyl)-1H-indole-1-carboxylate

  • CAS No. 218772-62-4

  • Cat. No. CS-M0670
  • Purity≥98%
  • MDL No.MFCD08275206

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

tert-Butyl 3-(cyanomethyl)-1H-indole-1-carboxylate|CS-M0670

Structure of 218772-62-4

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General Information

  • CAS No. 218772-62-4
  • Cat. No. CS-M0670
  • Purity ≥98%
  • MDL No. MFCD08275206
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₆N₂O₂
  • Molecular Weight 256.30
  • Synonym(s) [1-(tert-Butoxycarbonyl)indol-3-yl]acetonitrile
  • SMILES N#CCC1=CN(C2=CC=CC=C21)C(OC(C)(C)C)=O

Synthesis

  • Route1

    References

    • EXELIXIS, INC. Patent: WO2007/70796 A1, 2007 ; Location in patent: Page/Page column 110; 111; 117 ; WO 2007/070796 A1

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   55.02
  • LogP   3.49058
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   1

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