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CS-W001157 4
Total: USD 88.00

[(tert-butoxycarbonyl)amino](3-chlorophenyl)acetic acid

  • CAS No. 669713-92-2

  • Cat. No. CS-M2107
  • Purity≥98%
  • MDL No.MFCD03426365

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

[(tert-butoxycarbonyl)amino](3-chlorophenyl)acetic acid|CS-M2107

Structure of 669713-92-2

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General Information

  • CAS No. 669713-92-2
  • Cat. No. CS-M2107
  • Purity ≥98%
  • MDL No. MFCD03426365
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₆ClNO₄
  • Molecular Weight None
  • Synonym(s) None
  • SMILES ClC1=CC(C(C(O)=O)NC(OC(C)(C)C)=O)=CC=C1

Description

Boc-amino-3-chlorophenylacetic acid serves as a key building block in peptide synthesis and medicinal chemistry. The tert-butoxycarbonyl group provides stable protection of the amine, while the 3-chlorophenylacetic moiety offers a hydrophobic, electron-deficient aromatic handle for downstream functionalization. This compound enables efficient coupling under standard conditions.

Application

Boc-3-chlorophenylglycine serves as a versatile building block for peptide synthesis and medicinal chemistry, enabling efficient incorporation of a 3-chlorophenylalanine derivative. The tert-butoxycarbonyl (Boc) group provides robust protection of the amine, ensuring stability during storage and compatibility with standard deprotection protocols. Its ortho-chloro-substituted aromatic ring offers favorable electronic and steric properties for downstream functionalization. The molecule exhibits excellent bench stability, ease of purification, and broad functional group tolerance in coupling reactions, facilitating its use in constructing bioactive scaffolds and heterocyclic systems.

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-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   75.63
  • LogP   2.9904
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   3

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