(2-Phenyl-1H-imidazole-4,5-diyl)dimethanol

Name: (2-Phenyl-1H-imidazole-4,5-diyl)dimethanol
Brand: ChemScene
Availability: InStock
Rating: 5 (1 reviews)

CAS No. 61698-32-6
Cat. No. CS-0156388
Purity≥97%
MDL No.MFCD00047017

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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(2-Phenyl-1H-imidazole-4,5-diyl)dimethanol|CS-0156388

Structure of 61698-32-6

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General Information

CAS No. 61698-32-6
Cat. No. CS-0156388
Purity ≥97%
MDL No. MFCD00047017
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₁H₁₂N₂O₂
Molecular Weight 204.23
Synonym(s) 4,5-dihydroxymethyl-2-phenylimidazole
SMILES C1=CC=C(C=C1)C2=NC(=C(CO)N2)CO

Description

This imidazole-based diol features a rigid aromatic core with two hydroxymethyl groups, enabling dual functionalization. The electron-rich imidazole ring enhances solubility in polar solvents and supports robust stability under standard bench conditions. This scaffold integrates readily into molecular architectures requiring precise spatial orientation and hydrogen-bonding capacity.

Application

(2-Phenyl-1H-imidazole-4,5-diyl)dimethanol serves as a versatile bis-functional building block for the synthesis of imidazole-based scaffolds. Its two primary alcohol functionalities enable straightforward derivatization via esterification or etherification, while the electron-rich imidazole core facilitates transition-metal-catalyzed coupling reactions. The compound exhibits good bench stability and compatibility with standard purification methods, making it well-suited for use in medicinal chemistry campaigns and materials science applications requiring robust heterocyclic linkers.

Synthesis

Route1
- In-stock
  
  670-96-2
- 50-00-0
- ~91%
- In-stock
  
  61698-32-6
References
- Shikoku Chemicals Corporation Patent: US4104473 A1, 1978 ;
Route2
- In-stock
  
  670-96-2
- ~94%
- In-stock
  
  61698-32-6
References
- Shikoku Chemicals Corporation Patent: US4104473 A1, 1978 ;

Safety Information

Download SDS

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-P280-P302+P352

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Computational Chemistry Data

TPSA 69.14
LogP 1.0613
H_Acceptors 3
H_Donors 3
Rotatable_Bonds 3

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Imidazole compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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(2-Phenyl-1H-imidazole-4,5-diyl)dimethanol

CAS No. 61698-32-6

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