82891-99-4

Basic information

• Product Name: 2-(2-Nitroethyl)-[1,3]dioxolane
• Synonyms: 3-NITROPROPIONALDEHYDE ETHYLENE GLYCOL ACETAL;2-(2-NITROETHYL)-1,3-DIOXOLANE;1,3-Dioxolane, 2-(2-nitroethyl)-;2-(2-NITROETHYL)-1,3-DIOXOLANE FOR SYNTH
• CAS NO: 82891-99-4
• Molecular Formula: C₅H₉NO₄
• Molecular Weight: 147.13
• Mol File: 82891-99-4.mol

Chemical Properties

• Boiling Point: 68 °C(Press: 0.25 Torr)
• Appearance: White powder
• Density: 1.214±0.06 g/cm3(Predicted)
• Storage Temp.: Store below +30°C.
• PKA: 8.47±0.58(Predicted)
• CAS DataBase Reference: 2-(2-Nitroethyl)-[1,3]dioxolane(CAS DataBase Reference)
• NIST Chemistry Reference: 2-(2-Nitroethyl)-[1,3]dioxolane(82891-99-4)
• EPA Substance Registry System: 2-(2-Nitroethyl)-[1,3]dioxolane(82891-99-4)

Safety Data

• Hazard Codes: Xi
• Safety Statements: 24/25
• Hazardous Substances Data: 82891-99-4(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Industry:
2-(2-Nitroethyl)-[1,3]dioxolane is used as a solvent and reagent for the synthesis of various pharmaceutical compounds. Its properties make it suitable for facilitating chemical reactions in the production of medications.
Used in Agrochemical Industry:
In the agrochemical industry, 2-(2-Nitroethyl)-[1,3]dioxolane serves as a reagent in the synthesis of agrochemicals, contributing to the development of products for agricultural applications.
Used as an Intermediate in Organic Compound Production:
2-(2-Nitroethyl)-[1,3]dioxolane is utilized as an intermediate in the production of other organic compounds, playing a crucial role in the synthesis of various chemical entities.
Safety Precautions:
Due to its classification as a hazardous substance, 2-(2-Nitroethyl)-[1,3]dioxolane requires careful handling and storage. Its flammability and potential to cause skin and eye irritation necessitate adherence to proper safety measures to prevent accidents and exposure.

Upstream product

• 58657-26-4 3-nitropropionaldehyde 
• 107-21-1 ethylene glycol 
• 18742-02-4 2-bromo-2-(2-ethyl)dioxolane 

Downstream Products

• 1312809-32-7 C₁₄H₁₇NO₄ 
• 956316-86-2 benzyl 2-(4-((1,3-dioxolan-2-yl)methyl)-5-(4-fluorophenyl)-1-isopropyl-1H-pyrazol-3-yl)ethylcarbamate 
• 1312809-31-6 2-(1-hydroxy-4-oxo-cyclohexa-2,5-dienyl)-pyran-4-one 
• 117016-27-0 2-(4-hydroxyphenyl)-4H-pyran-4-one 
• 96202-73-2 (Z)-1-(1,3-dioxolan-2-yl)-2-nitronon-6-en-3-one p-toluenesulfonylhydrazone 
• 96202-74-3 (Z)-1-(1,3-dioxolan-2-yl)-non-6-en-3-one p-toluenesulfonylhydrazone 
• 94480-27-0 (5S)-5-<(phenylmethoxy)methyl>-3-<(1,3-dioxolan-2-yl)methyl>-4,5-dihydroisoxazole 
• 94480-28-1 (S)-5-Benzyloxy-1-[1,3]dioxolan-2-yl-4-hydroxy-pentan-2-one 
• 94371-03-6 5-Benzyloxy-1-[1,3]dioxolan-2-yl-4-hydroxy-pentan-2-one 
• 80127-50-0 (2R,6S)-2-Benzyloxymethyl-4,4,6-trimethoxy-tetrahydro-pyran 
• 80127-49-7 (2R,6R)-2-Benzyloxymethyl-4,4,6-trimethoxy-tetrahydro-pyran 
• 80127-49-7 (2S,6S)-2-Benzyloxymethyl-4,4,6-trimethoxy-tetrahydro-pyran 
• 94480-30-5 (2S,6R)-2-Benzyloxymethyl-4,4,6-trimethoxy-tetrahydro-pyran 
• 80127-51-1 (2S,6S)-2-Benzyloxymethyl-6-methoxy-tetrahydro-pyran-4-one 

Relevant articles and documents

NOVEL COMPOUNDS AS INHIBITORS OF DNA METHYLTRANSFERASES

It relates to the compounds of formula (I), or their pharmaceutically or veterinary acceptable salts, or their stereoisomers or mixtures thereof, wherein A, R1, R2, and R3 are as defined herein, which are inhibitors of one or more DNMTs selected from the group consisting of DNMT1, DNMT3A and DNMT3B. It also relates to pharmaceutical or veterinary compositions containing them, and to their use in medicine, in particular in the treatment and/or prevention of cancer, fibrosis and/or immunomodulation.

Studies on synthesis of a novel, broad-spectrum antitumor compound 2-(1-hydroxy-4-oxo-cyclohexa-2, 5-dienyl)-pyran-4-one

Based on the previous studies, used protoapigenone as a model, we adopted chemical synthesis methods to develop the new compounds. It was specifically named as 2-(1-hydroxy-4-oxo-2, 5-cyclohexadien-1-yl)-4H-Pyran-4-one, including a core group: 1-hydroxycy

Henry reaction of fluorinated nitro compounds

The Henry (nitroaldol) reaction of fluorinated nitro compounds with various aromatic aldehydes and a fluorinated aliphatic aldehyde to give β-fluoro-β-nitroalcohols which bearing a fluorinated quaternary carbon center was reported. The relative configuration of the major diastereoisomer of 2-fluoro-2-nitro-1-(4-nitrophenyl)-3-phenylpropanol (5bf) was determined by X-ray single crystal analysis.

A novel, broad-spectrum antitumor compound containing the 1-hydroxycyclohexa-2,5-dien-4-one group: The disclosure of a new antitumor pharmacophore in protoapigenone 1

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Cycloadditions of nitrile oxides with acryloyl derivatives of Oppolzer's chiral sultam produce stereoisomeric Δ2-isoxazolines in ratios of about 90/10 at 25 deg C.The major diastereomers can be isolated in pure form in 70-88percent yield.Synthe

3-Nitropropanal and 3-Nitropropanol: Preparation of the Parent Compounds and Derivatives

3-Nitropropanal has been prepared for the first time by 1,4-nitrite addition to acrolein.Several acetals of 3-nitropropanal are described, as well as 3-nitropropanol and some of its ethers. 3-Nitropropanol has been obtained by borane-dimethyl sulfide reduction of both 3-nitropropanal and 3-nitropropanoic acid.These reactions make available a variety of nitro compounds known as, or expected to become, highly useful and versatile building blocks for organic syntheses.

2-(2-NITROETHYL)-1,3-DIOXOLANE AS REAGENT FOR 3-OXOPROPYL ANION SYNTHON: A NEW ROUTE TO JASMONOID AND PROSTAGLANDIN INTERMEDIATES

2-(2-Nitroethyl)-1,3-dioxolane is a versatile reagent for 3-oxopropyl anion synthon.New methodology, based on nitroaldol condensation, oxidation and direct or indirect denitration sequence is developed for the conversion of 2-(2-nitroethyl)-1,3-dioxolane into (Z)-1,4-dioxodec-7-ene, (Z)-2-(2-pentenyl)-2-cyclopenten-1-one, methyl 9,12-dioxododecanoate and methyl 7-(5-oxocyclopentenyl)heptanoate, which are popular intermediates for syntheses of (Z)-jasmonoids and prostaglandins.

α-Nitro Ketones and Esters from Acylimidazoles

The anion of 2-(2-nitroethyl)-1,3-dioxolane (4), prepared from the corresponding 2-bromo compound (3), undergoes condensation with acylimidazoles to give the 3-nitro-4-oxobutanal acetals (9), which can serve as valuable polyfunctional intermediates.Condensation with 1-(methoxyoxalyl)imidazole gives the tetrafunctionalized methyl 4-(1,3-dioxolan-2-yl)-3-nitro-2-oxobutanoate (13), which, however, decomposed on attempted deprotection of the ester function.The syntheses in excellent yields of simple α-nitro ketones and α-nitro esters from acylimidazoles and nitroethane and 2-nitropropane are also described.