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CS-W001157 4
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(R)-4-(1-Aminoethyl)benzonitrile

  • CAS No. 210488-53-2

  • Cat. No. CS-B0178
  • Molecule weight146.19
  • Purity≥98%
  • MDL No.MFCD09829185

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

(R)-4-(1-Aminoethyl)benzonitrile|CS-B0178

Structure of 210488-53-2

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General Information

  • CAS No. 210488-53-2
  • Cat. No. CS-B0178
  • Purity ≥98%
  • MDL No. MFCD09829185
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀N₂
  • Molecular Weight 146.19
  • Synonym(s) 4-[(1S)-1-aminoethyl]benzonitrile
  • SMILES N#CC1=CC=C([C@@H](C)N)C=C1

Description

(R)-4-(1-Aminoethyl)benzonitrile features a chiral α-amino nitrile scaffold with a para-cyano group, enabling direct incorporation into asymmetric synthesis. The benzonitrile moiety provides a robust handle for further functionalization, while the (R)-configured aminoethyl side chain ensures high stereoselectivity in downstream transformations. This bench-stable compound serves as a key intermediate in medicinal chemistry and catalyst development.

Application

(R)-4-(1-Aminoethyl)benzonitrile serves as a chiral building block for the synthesis of bioactive molecules, enabling efficient access to enantioselective pharmaceutical intermediates. Its benzonitrile group facilitates diverse transformations including nucleophilic additions and transition-metal-catalyzed couplings, while the (R)-configured aminoethylenic side chain provides stereochemical control in downstream derivatization. The compound exhibits bench stability and compatibility with standard purification methods, making it well-suited for use in medicinal chemistry campaigns requiring high enantiomeric purity and predictable reactivity.

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   49.81
  • LogP   1.57798
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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