94944-62-4

Basic information

• Product Name: 1,3-DIOXOLANE-4-PROPANENITRILE, 2,2-DIMETHYL-, (4S)-
• Synonyms: 1,3-DIOXOLANE-4-PROPANENITRILE, 2,2-DIMETHYL-, (4S)-
• CAS NO: 94944-62-4
• Molecular Formula: C₈H₁₃NO₂
• Molecular Weight: 155.19432
• Mol File: 94944-62-4.mol
• Article Data: 6

Chemical Properties

• Boiling Point: 246.3°C at 760 mmHg
• Flash Point: 97.3°C
• Appearance: /
• Density: 0.99g/cm³
• Vapor Pressure: 0.0274mmHg at 25°C
• Refractive Index: 1.427
• CAS DataBase Reference: 1,3-DIOXOLANE-4-PROPANENITRILE, 2,2-DIMETHYL-, (4S)-(CAS DataBase Reference)
• NIST Chemistry Reference: 1,3-DIOXOLANE-4-PROPANENITRILE, 2,2-DIMETHYL-, (4S)-(94944-62-4)
• EPA Substance Registry System: 1,3-DIOXOLANE-4-PROPANENITRILE, 2,2-DIMETHYL-, (4S)-(94944-62-4)

Safety Data

• Hazardous Substances Data: 94944-62-4(Hazardous Substances Data)

Usage

General Description

1,3-Dioxolane-4-propanenitrile, 2,2-dimethyl-, (4S)-, also known as Dioxolane, is a chemical compound with the molecular formula C7H11NO2. It is a clear, colorless liquid and is commonly used as a solvent in various industrial and laboratory processes. It is also used in the production of pharmaceuticals, pesticides, and other organic compounds. The (4S) in the chemical name refers to the stereochemistry of the molecule, indicating that it has a specific three-dimensional arrangement of atoms. 1,3-DIOXOLANE-4-PROPANENITRILE, 2,2-DIMETHYL-, (4S)- is flammable and should be handled with care, following proper safety precautions in its use and storage.

InChI:InChI=1/C8H13NO2/c1-8(2)10-6-7(11-8)4-3-5-9/h7H,3-4,6H2,1-2H3/t7-/m0/s1

Upstream product

• 39029-45-3 3-(2,2-dimethyl-1,3-dioxolan-4-yl)acrylonitrile 
• 1707-77-3 1,2:5,6-di-O-isopropylidene-D-mannitol 
• 15186-48-8 2,3-isopropylidene-glyceraldehyde 
• 32233-43-5 2-[(S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethanol 
• 94992-56-0 (S)-1,2-O-isopropylidene-4-O-<(4-methylphenyl)sulfonyl>-1,2,4-butanetriol 
• 42890-78-8 (S)-(-)-isopropylidenedioxybutyl bromide 
• 143-33-9 sodium cyanide 

Downstream Products

• 94944-63-5 (S)-1,2-O-isopropylidene-5-amino-1,2-pentanediol 
• 143900-44-1 tert-butyl (3S)-3-hydroxypiperidine-1-carboxylate 
• 94944-69-1 (S)-3-hydroxypiperidine-N-carboxylate benzyl ester 
• 24211-55-0 (S)-3-hydroxypiperidine 
• 94944-61-3 (S)-N-<(benzyloxy)carbonyl>-1-O-<(4-methylphenyl)sulfonyl>-2-O-(2-tetrahydropyranyl)-5-amino-1,2-pentanediol 
• 94944-66-8 (S)-N-<(benzyloxy)carbonyl>-1-O-<(4-methylphenyl)sulfonyl>-5-amino-1,2-pentanediol 
• 94944-68-0 (S)-N-<(benzyloxy)carbonyl>-3-O-(2-tetrahydropyranyl)-3-piperidinol 
• 94944-64-6 (S)-N-<(benzyloxy)carbonyl>-1,2-O-isopropylidene-5-amino-1,2-pentanediol 
• 94944-65-7 (S)-N-<(benzyloxy)carbonyl>-5-amino-1,2-pentanediol 
• 158010-32-3 (R)-1-Benzyloxy-14-(tert-butyl-diphenyl-silanyloxy)-tetradecan-4-ol 
• 158110-04-4 (2S)-1,2-epoxy-5-benzyloxy-pentane 
• 172689-00-8 (2S,5S)-1,2-Bis-O-(triisopropylsilyl)-8-(pivaloyloxy)octane-1,2,5-triol 
• 172689-11-1 2,2-Dimethyl-propionic acid (4S,7S)-4-(toluene-4-sulfonyloxy)-7,8-bis-triisopropylsilanyloxy-octyl ester 
• 172689-09-7 Toluene-4-sulfonic acid (S)-1-((S)-3,4-bis-triisopropylsilanyloxy-butyl)-hexyl ester 

Relevant articles and documents

Synthesis of C-nucleoside analogue of (S)-9-(2,3-dihydroxypropyl)adenine and related acyclonucleosides

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Functionalized Diorganozinc Compounds: Key Reagents for the Synthesis of Enantiomerically Pure 2,5-Disubstituted cis- and trans-Tetrahydrofurans

1,4-Diol derivatives 4a-i were synthesized stereoselectively by either reagent- or catalyst-controlled routes using the addition of functionalized diorganozinc reagents to aldehydes.The stereoselectivities along the reagent-controlled synthetic path were in the range between 80:20 and 95:5.The stereoselectivities along the catalyst route exceeded 95:5.The 1,4-diol derivatives 4 thus obtained were transformed into enantiomerically pure cis- and trans-2,5-disubstituted tetrahydrofurans (16-20) by means of an intramolecular Williamson reaction. - Keywords: Synthesis, stereoselective / Catalysis / Tetrahydrofurans / Dialkylzinc reagents

C-Nucleoside Studies. Part 21. Synthesis of Some Hydroxyalkylated Pyrrolo- and Thieno-pyrimidines Related to Known Antiviral Acyclonucleosides

Treatment of (S)-4,5-isopropylidenedioxypentanonitrile 17 with ethyl formate and sodium hydride gave a hydroxymethylene derivative which interacted with aminoacetonitrile to give 3-cyanomethyleneamino-2-acrylonitrile 19; this was elaborated via 3-amino-2-cyano-4-pyrrol 22 into 4-amino-7-pyrrolopyrimidine 9.Treatment of the hydroxymethylene derivative of 17 with methanesulphonyl chloride, followed by acetylthioacetonitrile and sodium carbonate in ethanol gave 3-amino-2-cyano-4-thiophene 25, convertible in two steps into 4-amino-7-thienopyrimidine 10. Similar chemistry was employed for the conversion of 5,6-isopropylidenedioxyhexanonitril 30 into the higher homologues 4-amino-7-(3,4-dihydroxybutyl)pyrrolo- and thieno-(3,2-d)pyrimidine 11 and 12, and for the preparation of 4-amino-7-(4-hydroxy-3-hydroxymethylbutyl)pyrrolopyrimidine 13 from 6-benzyloxy-5-benzyloxymethylhexanonitrile 41.The hydroxyalkylated products 9-13 are C-nucleosides analogues of known antiviral agents, but did display antiviral activity.