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16754-86-2

(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.

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  • (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 No: 16754-86-2

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  • 16754-86-2 Structure

  • Basic information

    1. 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
    2. 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
    3. CAS NO:16754-86-2
    4. Molecular Formula: C12H15N3O4S
    5. Molecular Weight: 297.33
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 16754-86-2.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 615.1°Cat760mmHg
    3. Flash Point: 325.8°C
    4. Appearance: /
    5. Density: 1.72g/cm3
    6. Vapor Pressure: 5.51E-16mmHg at 25°C
    7. Refractive Index: 1.772
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. 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)
    11. 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)
    12. 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

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 16754-86-2(Hazardous Substances Data)

16754-86-2 Usage

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.

Check Digit Verification of cas no

The CAS Registry Mumber 16754-86-2 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 1,6,7,5 and 4 respectively; the second part has 2 digits, 8 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 16754-86:
(7*1)+(6*6)+(5*7)+(4*5)+(3*4)+(2*8)+(1*6)=132
132 % 10 = 2
So 16754-86-2 is a valid CAS Registry Number.
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

16754-86-2SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-(hydroxymethyl)-5-(4-methylsulfanylpyrrolo[2,3-d]pyrimidin-7-yl)oxolane-3,4-diol

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

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:16754-86-2 SDS

16754-86-2Downstream Products

16754-86-2Relevant articles and documents

Synthesis, cytostatic, antimicrobial, and anti-HCV activity of 6-substituted 7-(het)aryl-7-deazapurine ribonucleosides

Nau?, Petr,Caletková, Olga,Kone?ny, Petr,D?ubák, Petr,Bogdanová, Kate?ina,Kolá?, Milan,Vrbková, Jana,Slavětínská, Lenka,Tlou?t'Ová, Eva,Perlíková, Pavla,Hajdúch, Marián,Hocek, Michal

, p. 1097 - 1110 (2014/03/21)

A series of 80 7-(het)aryl- and 7-ethynyl-7-deazapurine ribonucleosides bearing a methoxy, methylsulfanyl, methylamino, dimethylamino, methyl, or oxo group at position 6, or 2,6-disubstituted derivatives bearing a methyl or amino group at position 2, were

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