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CS-W001157 4
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2-(Aminomethyl)benzonitrile

  • CAS No. 344957-25-1

  • Cat. No. CS-W006008
  • Purity≥98%
  • MDL No.MFCD06797831

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

2-(Aminomethyl)benzonitrile|CS-W006008

Structure of 344957-25-1

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General Information

  • CAS No. 344957-25-1
  • Cat. No. CS-W006008
  • Purity ≥98%
  • MDL No. MFCD06797831
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈N₂
  • Molecular Weight 132.17
  • Synonym(s) 2-Cyanobenzylamine
  • SMILES NCC1=C(C#N)C=CC=C1

Description

2-Cyanobenzylamine delivers a strategically positioned nitrile group adjacent to a primary amine, enabling direct conjugation or functionalization in synthetic pathways. This ortho-substituted scaffold combines enhanced reactivity with stability under standard conditions, facilitating efficient incorporation into bioactive molecules and complex heterocycles.

Application

2-Cyanobenzylamine serves as a versatile building block in medicinal chemistry, enabling the synthesis of heterocyclic scaffolds and bioactive molecules. Its ortho-cyano group enhances electrophilicity for nucleophilic addition reactions, while the primary amine facilitates conjugation and derivatization. The compound exhibits good bench stability and is compatible with standard purification techniques, making it well-suited for multi-step synthetic sequences in API development.

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H300-H311+H331
Precautionary Statements : P261-P264-P280

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Computational Chemistry Data

  • TPSA   49.81
  • LogP   1.01698
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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