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Methyl 6-((tert-butoxycarbonyl)amino)nicotinate

  • CAS No. 144186-11-8

  • Cat. No. CS-0097456
  • Purity≥97%
  • MDL No.MFCD05663797

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

Methyl 6-((tert-butoxycarbonyl)amino)nicotinate|CS-0097456

Structure of 144186-11-8

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General Information

  • CAS No. 144186-11-8
  • Cat. No. CS-0097456
  • Purity ≥97%
  • MDL No. MFCD05663797
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₆N₂O₄
  • Molecular Weight 252.27
  • Synonym(s) methyl 6-nicotinoate
  • SMILES O=C(C1=CN=C(C=C1)NC(OC(C)(C)C)=O)OC

Synthesis

  • Route1

    References

    • Kempf, Dale J.; Sham, Hing L.; Marsh, Kennan C.; Flentge, Charles A.; Betebenner, David; Green, Brian E.; McDonald, Edith; Vasavanonda, Sudthida; Saldivar, Ayda; Wideburg, Norman E.; Kati, Warren M.; Ruiz, Lisa; Zhao, Chen; Fino, Lynnmarie; Patterson, Jean; Molla, Akhteruzzaman; Plattner, Jacob J.; Norbeck, Daniel W. Journal of Medicinal Chemistry, 1998 , vol. 41, # 4 p. 602 - 617
  • Route2

    References

    • ABRAXIS BIOSCIENCE, LLC; TAO, Chunlin; WANG, Qinwei; POLAT, Tulay; NALLAN, Laxman; DESAI, Neil Patent: WO2010/144345 A1, 2010 ; Location in patent: Page/Page column 64; 65 ; WO 2010/144345 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-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   77.52
  • LogP   2.2152
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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