94407-04-2

Basic information

• Product Name: 2-(1,3-dioxan-2-yl)-4-nitrophenol
• CAS NO: 94407-04-2
• Molecular Formula: C₁₀H₁₁NO₅
• Molecular Weight: 225.198
• Mol File: 94407-04-2.mol

Chemical Properties

• Boiling Point: 333°C at 760 mmHg
• Flash Point: 155.2°C
• Density: 1.381g/cm³
• Vapor Pressure: 7.29E-05mmHg at 25°C
• Refractive Index: 1.583
• CAS DataBase Reference: 2-(1,3-dioxan-2-yl)-4-nitrophenol(CAS DataBase Reference)
• NIST Chemistry Reference: 2-(1,3-dioxan-2-yl)-4-nitrophenol(94407-04-2)
• EPA Substance Registry System: 2-(1,3-dioxan-2-yl)-4-nitrophenol(94407-04-2)

Safety Data

• Hazardous Substances Data: 94407-04-2(Hazardous Substances Data)

Usage

Appearance

Yellow crystalline solid The compound has a yellow color and a crystalline structure, which refers to its solid form with a well-defined geometry and arrangement of atoms.

Reactivity

Highly reactive The presence of the dioxane ring and nitro group makes the compound more likely to undergo various chemical reactions, making it useful in organic synthesis.

Uses

Synthesis of organic compounds, building block in pharmaceutical industry Due to its reactivity, 2-(1,3-dioxan-2-yl)-4-nitrophenol is commonly used as an intermediate in the synthesis of other organic compounds and as a building block in the production of pharmaceuticals.

Toxicity

Mild toxicity The compound has a bitter taste and can be harmful if ingested or handled improperly. It is important to exercise caution when working with this substance.

Nitrophenol derivative

Contains a dioxane ring The compound is derived from nitrophenol and features a dioxane ring in its structure, which contributes to its reactivity and potential applications in various chemical reactions.

Upstream product

• 97-51-8 5-Nitrosalicylaldehyde 
• 504-63-2 trimethyleneglycol 

Downstream Products

• 872042-62-1 1-[4-(5-amino-6-chloro-pyrimidin-4-yloxy)-3-[1,3]dioxan-2-yl-phenyl]-3-(4-chloro-3-trifluoromethyl-phenyl)-urea 
• 872042-61-0 1-(4-chloro-3-trifluoromethyl-phenyl)-3-(3-[1,3]dioxan-2-yl-4-hydroxy-phenyl)-urea 
• 894099-98-0 4-amino-2-[1,3]dioxan-2-yl-phenol 

Relevant articles and documents

Acetalization of carbonyl compounds catalyzed by bismuth triflate under solvent-free conditions

Carbonyl compounds were converted to the corresponding 1,3-dioxolanes and 1,3-dioxanes with ethylene glycol and 1,3-propandiol in the presence of bismuth triflate under solvent-free conditions. In addition, high chemoselective protection of aldehydes in the presence of ketones has been achieved.

Pyrimido-oxazepine as a versatile template for the development of inhibitors of specific kinases

Pyrimido-oxazepine based sub-micromolar inhibitors (2-4) for Aurora and FLT-3 were designed and synthesized. These preliminary results supported the potential use of pyrimido-oxazepines as a versatile template for developing specific kinase inhibitors.