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CS-W001157 4
Total: USD 88.00

6-(((tert-Butoxycarbonyl)amino)methyl)nicotinic acid

  • CAS No. 170097-87-7

  • Cat. No. CS-0068038
  • Molecule weight252.27
  • Purity≥96%
  • MDL No.MFCD06657532

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

6-(((tert-Butoxycarbonyl)amino)methyl)nicotinic acid|CS-0068038

Structure of 170097-87-7

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General Information

  • CAS No. 170097-87-7
  • Cat. No. CS-0068038
  • Purity ≥96%
  • MDL No. MFCD06657532
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₆N₂O₄
  • Molecular Weight 252.27
  • Synonym(s) 6-(Boc-Aminomethyl)nicotinic acid
  • SMILES O=C(C1=CC=C(CNC(OC(C)(C)C)=O)N=C1)O

Description

This tert-butoxycarbonyl-protected nicotinic acid derivative features a strategically positioned amino-methyl side chain, enabling straightforward incorporation into peptide synthesis workflows. The Boc group ensures stability during handling and provides orthogonal protection for amine functionalities in multistep conjugation processes.

Application

6-(((tert-Butoxycarbonyl)amino)methyl)nicotinic acid serves as a versatile building block in medicinal chemistry, enabling the synthesis of bioactive heterocycles and peptide conjugates. The tert-butyl carbamate group provides stable protection of the primary amine under standard conditions, facilitating orthogonal functionalization. Its pyridine-carboxylic acid framework supports diverse transformations, including coupling reactions and cyclizations, while the bench-stable, crystalline nature simplifies handling and purification in multi-step syntheses.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501

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Computational Chemistry Data

  • TPSA   88.52
  • LogP   1.8045
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   3

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