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CS-W001157 4
Total: USD 88.00

6-(tert-Butyl)nicotinic acid

  • CAS No. 832715-99-8

  • Cat. No. CS-0043067
  • Purity≥98%
  • MDL No.MFCD08059362

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

6-(tert-Butyl)nicotinic acid|CS-0043067

Structure of 832715-99-8

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General Information

  • CAS No. 832715-99-8
  • Cat. No. CS-0043067
  • Purity ≥98%
  • MDL No. MFCD08059362
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₃NO₂
  • Molecular Weight 179.22
  • Synonym(s) 6-(1,1-dimethylethyl)-3-Pyridinecarboxylic acid
  • SMILES CC(C)(C)C1=CC=C(C=N1)C(O)=O

Synthesis

  • Route1

    References

    • CGI PHARMACEUTICALS, INC. Patent: WO2008/33858 A2, 2008 ; Location in patent: Page/Page column 206 ; WO 2008/033858 A2
  • Route2

    References

    • ARENA PHARMACEUTICALS, INC. Patent: WO2005/7658 A2, 2005 ; Location in patent: Page 229 ; WO 2005/007658 A2
  • Route3

    References

    • F. HOFFMANN-LA ROCHE AG; HOFFMANN-LA ROCHE INC.; HUBY, Nicholas John Silvester; LOPEZ-TAPIA, Francisco Javier; SO, Sung-Sau Patent: WO2014/90715 A1, 2014 ; Location in patent: Page/Page column 45 ;

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   50.19
  • LogP   2.0773
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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