14439-03-3

Basic information

• Product Name: Benzenemethanol, 3-nitro-a-(1-nitroethyl)-
• CAS NO: 14439-03-3
• Molecular Formula: C9H10N2O5
• Molecular Weight: 226.189
• Mol File: 14439-03-3.mol
• Article Data: 13

Chemical Properties

• CAS DataBase Reference: Benzenemethanol, 3-nitro-a-(1-nitroethyl)-(CAS DataBase Reference)
• NIST Chemistry Reference: Benzenemethanol, 3-nitro-a-(1-nitroethyl)-(14439-03-3)
• EPA Substance Registry System: Benzenemethanol, 3-nitro-a-(1-nitroethyl)-(14439-03-3)

Safety Data

• Hazardous Substances Data: 14439-03-3(Hazardous Substances Data)

Upstream product

• 79-24-3 Nitroethane 
• 99-61-6 3-nitro-benzaldehyde 

Downstream Products

• 134538-50-4 (E)-1-nitro-3-(2-nitro-propenyl)-benzene 
• 14367-81-8 2-Nitro-1-(3-nitro-phenyl)-propan-1-on 

Relevant articles and documents

Accelerating the optimization of enzyme-catalyzed synthesis conditionsviamachine learning and reactivity descriptors

Enzyme-catalyzed synthesis reactions are of crucial importance for a wide range of applications. An accurate and rapid selection of optimal synthesis conditions is crucial and challenging for both human knowledge and computer predictions. In this work, a

Henry reaction catalyzed by recyclable [C4dabco]OH ionic liquid

DABCO-based ionic liquid, 1-butyl-4-aza-1-azaniabicyclo[2.2.2]octane hydroxide, has been used as an efficient catalyst for Henry reaction of various carbonyl compounds with nitroalkanes affording very high yields within a short duration. This method is very simple, clean and avoids hazardous organic solvents. The catalyst can be easily recovered and recycled several times.

Polymer supported DMAP: An easily recyclable organocatalyst for highly atom-economical Henry reaction under solvent-free conditions

Polymer supported catalysts are regarded as a borderline class of catalysts, which retains the advantages of homogeneous catalysts while securing the ease of recovery by simple filtration and workup of heterogeneous systems. Additionally, such catalysts are less hygroscopic due to the long polymer backbone. Here we have demonstrated that a catalytic amount of polymer supported DMAP (10 mol%) can lead to excellent conversion of an equimolar mixture of aldehyde and nitroalkane exclusively into β-nitroalcohols via the Henry reaction. Unlike most of the commonly used catalysts, polymer supported DMAP can be recovered by simple filtration and reused several times, thereby reducing the operational cost. High synthetic efficiency, total atom economy, near quantitative yields, mild reaction conditions, operational simplicity, easy recovery and reusability of the catalyst, solvent-free reaction conditions and avoidance of traditional reaction workup make the protocol highly significant from Green and Sustainable Chemistry perspectives.