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(S)-3-Methyl-1-phenylbutan-1-amine hydrochloride

  • CAS No. 1269470-38-3

  • Cat. No. CS-0097724
  • Molecule weight199.72
  • Purity≥96%
  • MDL No.MFCD12910551

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

(S)-3-Methyl-1-phenylbutan-1-amine hydrochloride|CS-0097724

Structure of 1269470-38-3

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General Information

  • CAS No. 1269470-38-3
  • Cat. No. CS-0097724
  • Purity ≥96%
  • MDL No. MFCD12910551
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₈ClN
  • Molecular Weight 199.72
  • Synonym(s) None
  • SMILES N[C@@H](CC(C)C)C1=CC=CC=C1.[H]Cl

Description

(S)-3-Methyl-1-phenylbutan-1-amine hydrochloride is a chiral amine scaffold featuring a stereogenic center at the 3-position, enabling precise control in asymmetric synthesis. The phenyl group imparts rigidity and π-conjugation, while the protonated amine enhances solubility and facilitates salt formation for improved handling. This bench-stable derivative serves as a key building block in medicinal chemistry, particularly for designing enantioselective catalysts and bioactive molecules requiring defined stereochemistry.

Application

(S)-3-Methyl-1-phenylbutan-1-amine hydrochloride serves as a chiral building block for asymmetric synthesis, enabling the construction of biologically relevant amine scaffolds. Its bench-stable hydrochloride salt form facilitates handling and purification, while the stereogenic center supports enantioselective transformations. The molecule functions effectively in reductive amination, coupling reactions, and as a ligand precursor in transition metal catalysis.

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   26.02
  • LogP   3.1543
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   3

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