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CS-W001157 4
Total: USD 88.00

2-(1H-Benzo[d]imidazol-2-yl)ethanol

  • CAS No. 4857-01-6

  • Cat. No. CS-W013257
  • Purity≥97%
  • MDL No.MFCD00022686

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

2-(1H-Benzo[d]imidazol-2-yl)ethanol|CS-W013257

Structure of 4857-01-6

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General Information

  • CAS No. 4857-01-6
  • Cat. No. CS-W013257
  • Purity ≥97%
  • MDL No. MFCD00022686
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀N₂O
  • Molecular Weight 162.19
  • Synonym(s) 2-(2-Hydroxyethyl)benzimidazole
  • SMILES OCCC1=NC2=CC=CC=C2N1

Description

2-(1H-Benzo[d]imidazol-2-yl)ethanol features a benzimidazole core linked to a hydroxyethyl side chain, enabling dual hydrogen-bonding capacity and enhanced solubility. This scaffold integrates readily into bioactive molecules, serving as a key building block in medicinal chemistry for ligands targeting receptor systems. The pendant alcohol group supports derivatization under standard conditions, facilitating conjugation or further functionalization.

Application

2-(1H-Benzo[d]imidazol-2-yl)ethanol serves as a versatile building block for heterocyclic synthesis, enabling efficient access to bioactive scaffolds. Its benzoimidazole core offers enhanced metabolic stability and π-stacking potential, while the terminal primary alcohol facilitates straightforward derivatization via esterification, etherification, or coupling reactions. The compound exhibits good bench stability and is readily purified by column chromatography, making it well-suited for medicinal chemistry campaigns and process development workflows.

Synthesis

  • Route1

    References

    • Journal of the American Chemical Society, , vol. 71, p. 1985,1986

Safety Information

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GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H302-H315-H318-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   48.91
  • LogP   1.0977
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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