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2,3,4-Trihydroxy-4-(2-phenyl-2H-1,2,3-triazol-4-yl)butyl 4-methylbenzenesulfonate is a complex chemical compound characterized by the presence of three hydroxyl groups, a butyl chain with a triazole ring and a phenyl group, and a 4-methylbenzenesulfonate moiety. Its molecular structure suggests potential applications in pharmaceuticals and organic chemistry, with the triazole and phenyl groups being common pharmacophores in drug design. The hydroxyl groups may confer biological activity, such as antioxidant or chelating properties, while the sulfonate group could be useful as a synthetic intermediate or reagent.

99099-78-2

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99099-78-2 Usage

Uses

Used in Pharmaceutical Industry:
2,3,4-Trihydroxy-4-(2-phenyl-2H-1,2,3-triazol-4-yl)butyl 4-methylbenzenesulfonate is used as a potential pharmaceutical candidate for drug development due to its triazole and phenyl groups, which are prevalent in medicinal chemistry for their ability to interact with biological targets and modulate various biological pathways.
Used in Organic Chemistry:
In the field of organic chemistry, 2,3,4-Trihydroxy-4-(2-phenyl-2H-1,2,3-triazol-4-yl)butyl 4-methylbenzenesulfonate is utilized as a synthetic intermediate, enabling the synthesis of more complex molecules with potential applications in various chemical processes.
Used as a Reagent:
The presence of the sulfonate group in 2,3,4-Trihydroxy-4-(2-phenyl-2H-1,2,3-triazol-4-yl)butyl 4-methylbenzenesulfonate makes it a valuable reagent in organic chemistry, facilitating specific reactions and transformations that are otherwise challenging to achieve.
While the specific applications and uses of 2,3,4-TRIHYDROXY-4-(2-PHENYL-2H-1,2,3-TRIAZOL-4-YL)BUTYL 4-METHYLBENZENESULFONATE are not explicitly detailed in the provided materials, the molecular features and structural components suggest a wide range of potential applications in both pharmaceutical and chemical research and development. Further investigation and experimentation would be necessary to fully explore and validate these applications.

Check Digit Verification of cas no

The CAS Registry Mumber 99099-78-2 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 9,9,0,9 and 9 respectively; the second part has 2 digits, 7 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 99099-78:
(7*9)+(6*9)+(5*0)+(4*9)+(3*9)+(2*7)+(1*8)=202
202 % 10 = 2
So 99099-78-2 is a valid CAS Registry Number.
InChI:InChI=1/C19H21N3O6S/c1-13-7-9-15(10-8-13)29(26,27)28-12-17(23)19(25)18(24)16-11-20-22(21-16)14-5-3-2-4-6-14/h2-11,17-19,23-25H,12H2,1H3/t17-,18-,19-/m1/s1

99099-78-2SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name [2,3,4-trihydroxy-4-(2-phenyltriazol-4-yl)butyl] 4-methylbenzenesulfonate

1.2 Other means of identification

Product number -
Other names -

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

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More Details:99099-78-2 SDS

99099-78-2Relevant academic research and scientific papers

Synthesis and antiviral activity evaluation of novel 2-phenyl-4-(D-arabino-4′-cycloaminobutyl)triazoles: Acyclonucleosides containing unnatural bases

Tyagi, Rahul,Olsen, Carl E.,Errington, William,Parmar, Virinder S.,Prasad, Ashok K.

, p. 963 - 968 (2007/10/03)

Five 2-phenyl-4-(D-arabino-4′-cycloamino-3′-hydroxy-O-1′,2′-isopropylidenebutyl)-2H-1,2,3-triazoles, acyclonucleosides containing unnatural bases have been synthesised by opening of the epoxide ring of 2-phenyl-4-(D-arabino-3′,4′-epoxy-O-1′,2′-isopropylidenebutyl)-2H-1,2,3-triazole with the corresponding cyclic amine in 70-85% yields. The starting arabino-epoxytriazole was prepared in five steps starting from D-glucose in an overall yield of 15%. All the five triazolylacycllonucleosides were unambiguously identified on the basis of their spectral data. The structure of one of the intermediates, that is 2-phenyl-4-(D-arabino-1′,2′,3′,4′-tetrahydroxybutyl)-2H-1,2,3-triazole was confirmed by its X-ray crystallographic studies. These acyclonucleosides were subjected to antiviral evaluation in CEM-SS cell-based anti HIV assay with the lymphocytropic virus strains HIV-1IIIB and HIV-1RF. Copyright

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