16754-86-2

Basic information

• Product Name: (2R,4R,5R)-2-(hydroxymethyl)-5-(5-methylsulfanyl-2,4,9-triazabicyclo[4.3.0]nona-2,4,7,10-tetraen-9-yl)oxolane-3,4-diol
• Synonyms: (2R,4R,5R)-2-(hydroxymethyl)-5-(5-methylsulfanyl-2,4,9-triazabicyclo[4.3.0]nona-2,4,7,10-tetraen-9-yl)oxolane-3,4-diol;Nsc105826
• CAS NO: 16754-86-2
• Molecular Formula: C12H15N3O4S
• Molecular Weight: 297.33
• Mol File: 16754-86-2.mol
• Article Data: 2

Chemical Properties

• Boiling Point: 615.1°Cat760mmHg
• Flash Point: 325.8°C
• Appearance: /
• Density: 1.72g/cm³
• Vapor Pressure: 5.51E-16mmHg at 25°C
• Refractive Index: 1.772
• CAS DataBase Reference: (2R,4R,5R)-2-(hydroxymethyl)-5-(5-methylsulfanyl-2,4,9-triazabicyclo[4.3.0]nona-2,4,7,10-tetraen-9-yl)oxolane-3,4-diol(CAS DataBase Reference)
• NIST Chemistry Reference: (2R,4R,5R)-2-(hydroxymethyl)-5-(5-methylsulfanyl-2,4,9-triazabicyclo[4.3.0]nona-2,4,7,10-tetraen-9-yl)oxolane-3,4-diol(16754-86-2)
• EPA Substance Registry System: (2R,4R,5R)-2-(hydroxymethyl)-5-(5-methylsulfanyl-2,4,9-triazabicyclo[4.3.0]nona-2,4,7,10-tetraen-9-yl)oxolane-3,4-diol(16754-86-2)

Safety Data

• Hazardous Substances Data: 16754-86-2(Hazardous Substances Data)

Usage

Description

(2R,4R,5R)-2-(hydroxymethyl)-5-(5-methylsulfanyl-2,4,9-triazabicyclo[4.3.0]nona-2,4,7,10-tetraen-9-yl)oxolane-3,4-diol is a complex organic molecule with a unique structure that features a sugar-like backbone and a tricyclic component containing a sulfur atom. Its stereochemistry is denoted by the (2R,4R,5R) prefix, which indicates the specific configuration of its chiral centers. The presence of the hydroxymethyl group and the oxolane-3,4-diol moiety suggests potential reactivity with other biomolecules, while the tricyclic portion may contribute to specific pharmacological properties. (2R,4R,5R)-2-(hydroxymethyl)-5-(5-methylsulfanyl-2,4,9-triazabicyclo[4.3.0]nona-2,4,7,10-tetraen-9-yl)oxolane-3,4-diol's intricate structure, characterized by both its sugar and tricyclic components, may indicate its potential use in medicinal chemistry or as a synthetic building block.

Uses

Used in Medicinal Chemistry:
(2R,4R,5R)-2-(hydroxymethyl)-5-(5-methylsulfanyl-2,4,9-triazabicyclo[4.3.0]nona-2,4,7,10-tetraen-9-yl)oxolane-3,4-diol is used as a potential pharmaceutical candidate for the development of new drugs due to its unique structure and the presence of functional groups that can interact with biomolecules.
Used in Synthetic Chemistry:
In the field of synthetic chemistry, (2R,4R,5R)-2-(hydroxymethyl)-5-(5-methylsulfanyl-2,4,9-triazabicyclo[4.3.0]nona-2,4,7,10-tetraen-9-yl)oxolane-3,4-diol serves as a valuable building block for the synthesis of more complex molecules with potential applications in various industries, including pharmaceuticals, materials science, and agrochemicals.

InChI:InChI=1/C12H15N3O4S/c1-20-11-6-2-3-15(10(6)13-5-14-11)12-9(18)8(17)7(4-16)19-12/h2-3,5,7-9,12,16-18H,4H2,1H3

Upstream product

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• 5188-07-8 sodium thiomethoxide 
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Downstream Products

• 69-33-0 tubercidin 

Relevant articles and documents

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