6022-96-4

Basic information

• Product Name: (4-hydroxy-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]oct-3-yl)methyl benz oate
• Synonyms: (4-hydroxy-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]oct-3-yl)methyl benz oate;Nsc127670;5-O-Benzoyl-1,2-O-isopropylidene-alpha-D-xylofuranose;1,2-O-Isopropylidene-5-benzoate--alpha-D-xylofuranose;5-O-Benzoyl-1,2-di-O-isopropylidene-alpha-D-xylofuranose;1,2-O-(1-Methylethylidene)-alpha-D-xylofuranose 5-benzoate;5-O-benzoyl-α-D-xylofuranose;[(3aR,5R,6S,6aR)-6-hydroxy-2,2-dimethyl-tetrahydro-2H-furo[2,3-d][1,3]dioxol-5-yl]methyl benzoate
• CAS NO: 6022-96-4
• Molecular Formula: C₁₅H₁₈O₆
• Molecular Weight: 294.3
• Mol File: 6022-96-4.mol
• Article Data: 38

Chemical Properties

• Boiling Point: 432°C at 760 mmHg
• Flash Point: 159.2°C
• Appearance: /
• Density: 1.253g/cm³
• Vapor Pressure: 3.14E-08mmHg at 25°C
• Refractive Index: 1.532
• PKA: 13.10±0.60(Predicted)
• CAS DataBase Reference: (4-hydroxy-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]oct-3-yl)methyl benz oate(CAS DataBase Reference)
• NIST Chemistry Reference: (4-hydroxy-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]oct-3-yl)methyl benz oate(6022-96-4)
• EPA Substance Registry System: (4-hydroxy-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]oct-3-yl)methyl benz oate(6022-96-4)

Safety Data

• Hazardous Substances Data: 6022-96-4(Hazardous Substances Data)

Usage

General Description

The chemical (4-hydroxy-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]oct-3-yl)methyl benzoate is a synthetic compound with a complex structure that includes a bicyclic ring system and a benzene ring. It is formed by the esterification of 4-hydroxy-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]oct-3-yl)methanol with benzoic acid. This chemical compound is primarily used in the production of perfumes, soaps, and other personal care products to impart a pleasant scent. It is also used as a flavoring agent in food and beverages. Additionally, it may have potential applications in pharmaceuticals and other industries due to its unique chemical structure and properties.

InChI:InChI=1/C15H18O6/c1-15(2)20-12-11(16)10(19-14(12)21-15)8-18-13(17)9-6-4-3-5-7-9/h3-7,10-12,14,16H,8H2,1-2H3

Upstream product

• 98-88-4 benzoyl chloride 
• 20031-21-4 1,2-O-isopropylidene-α-D-xylose 
• 532-20-7 D-xylofuranose 
• 16749-42-1 5,6-dideoxy-1,2-O-isopropylidene-α-D-xylo-hexofuranose 
• 87-72-9 D-Xylose 
• 20881-04-3 1,2,3,5-di-O-isopropylidene-D-xylofuranose 
• 769-78-8 vinyl benzoate 
• 532-32-1 sodium benzoate 
• 20881-04-3 1,2:3,5-di-O-isopropylidene-D-xylofuranose 
• 58-86-6 D-xylose 
• 19820-60-1 Benzoic trimethylacetic anhydride 

Downstream Products

• 94795-72-9 1,2-O-isopropylidene-5-O-benzoyl-3-O-trifluoromethanesulfonyl-α-D-xylofuranose 
• 160999-15-5 5-O-benzoyl-3-O-(1-imidazolylthiocarbonyl)-1,2-O-isopropylidene-α-D-xylofuranose 
• 143653-59-2 Benzoic acid (3aR,5R,6S,6aR)-2,2-dimethyl-6-phenoxythiocarbonyloxy-tetrahydro-furo[2,3-d][1,3]dioxol-5-ylmethyl ester 
• 6698-46-0 5-O-benzoyl-1,2-O-isopropylidene-α-D-ribofuranos-3-ulose 
• 4105-29-7 [(3aR,5S,6aR)-2,2-dimethyltetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate 
• 59896-02-5 ((3aR,5S,6aR)-2,2-dimethyl-6-methylenetetrahydrofuro[2,3-d][1,3]dioxol-5-yl)methyl benzoate 
• 234088-61-0 methyl 5-O-benzoyl-3-deoxy-3-C-methylene-D-xylofuranoside 
• 234088-62-1 1,4-anhydro-5-O-benzoyl-3-deoxy-3-C-methylene-D-erythro-pentitol 
• 406212-13-3 (2S,4S)-6-chloro-9-(2-benzoyloxymethyl-3-methylene-tetrahydrofuran-4-yl)-9H-purine 
• 406212-11-1 (2S,4S)-3-benzoyl-1-(2-benzoyloxymethyl-3-methylene-tetrahydrofuran-4-yl)-1H-pyrimidine-2,4-dione 
• 406212-14-4 (2S,4S)-2-acetamido-6-chloro-9-(2-benzoyloxymethyl-3-methylene-tetrahydrofuran-4-yl)-9H-purine 
• 1332508-12-9 1,2-O-isopropylidene-5-O-benzoyl-3-phenylsulfanyl-3-deoxy-α-D-ribofuranose 
• 1332508-14-1 1,2-O-isopropylidene-3-phenylsulfanyl-3-deoxy-α-D-ribofuranose 
• 1332508-20-9 C₄₂H₅₇O₆PS 

Relevant articles and documents

Synthesis and evaluation of 3′-fluorinated 7-deazapurine nucleosides as antikinetoplastid agents

Kinetoplastid parasites are the causative agents of neglected tropical diseases with an unmet medical need. These parasites are unable to synthesize the purine ring de novo, and therefore rely on purine salvage to meet their purine demand. Evaluating purine nucleoside analogs is therefore an attractive strategy to identify antikinetoplastid agents. Several anti-Trypanosoma cruzi and anti-Trypanosoma brucei 7-deazapurine nucleosides were previously discovered, with the removal of the 3′-hydroxyl group resulting in a significant boost in activity. In this work we therefore decided to assess the effect of the introduction of a 3′-fluoro substituent in 7-deazapurine nucleosides on the anti-kinetoplastid activities. Hence, we synthesized two series of 3′-deoxy-3′-fluororibofuranosyl and 3′-deoxy-3′-fluoroxylofuranosyl nucleosides comprising 7-deazaadenine and -hypoxanthine bases and assayed these for antiparasitic activity. Several analogs with potent activity against T. cruzi and T. brucei were discovered, indicating that a fluorine atom in the 3′-position is a promising modification for the discovery of antiparasitic nucleosides.

CYCLIC DINUCLEOTIDES AS STING AGONISTS

Disclosed herein are cyclic di-nucleotide compounds and derivatives thereof that may be useful as STING agonists, and a pharmaceutical composition comprising the same. Also disclosed herein is the process for synthesis and to uses of such cyclic di-nucleo

SELECTIVE INHIBITORS OF PROTEIN ARGININE METHYLTRANSFERASE 5

The disclosure is directed to methods of treating disease using compounds of Formula (I).