5'-O-[(4-Methylphenyl)sulfonyl]thymidine

Basic Information

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CAS Number

7253-19-2

Molecular Formula

C17H20N2O7S

Molecular Weight

396.42 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

SMILES

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CC1=CC=C(C=C1)S(=O)(=O)OCC2C(CC(O2)N3C=C(C(=O)NC3=O)C)O

InChI

InChI=1S/C17H20N2O7S/c1-10-3-5-12(6-4-10)27(23,24)25-9-14-13(20)7-15(26-14)19-8-11(2)16(21)18-17(19)22/h3-6,8,13-15,20H,7,9H2,1-2H3,(H,18,21,22)/t13-,14+,15+/m0/s1

InChIKey

RSEWNGNFIIXLHN-RRFJBIMHSA-N

LogP

0.20733999999999975

Topological Polar Surface Area

127.69 Å²

Hydrogen Bond Donor/Acceptor

2 / 9

Complexity

722

Safety Information

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Hazard Statement

Synonyms & References

English

NSC69443
DTXSID10993373
NSC 69443
5'-O-Tosylthymidine
NSC-69443
1-[2-Deoxy-5-O-(4-methylbenzene-1-sulfonyl)pentofuranosyl]-4-hydroxy-5-methylpyrimidin-2(1H)-one
Thymidine, 5'-(4-methylbenzenesulfonate)
Thymidine, 5'-o-(p-toluenesulfonyl)-
[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl 4-methylbenzenesulfonate
SR-01000359272
FT-0675340
BRN 0632553
SR-01000359272-1
WLN: T6NVMVJ E1 A- BT5OTJ DQ E1SWR D1
7253-19-2
5’-Tosyl Thymidine
5'-O-(4-METHYLPHENYLSULPHONYL)THYMIDINE
5'-TOSYL THYMIDINE
Thymidine,5'-(4-methylbenzenesulfonate)
5'-O-p-toluenesulfonylthymidine
5'-O-p-tolylsulfonylthymidine
5'-O-p-tosyl-thymidine
5'-O-TOLUOLSULFONYL-THYMIDINE
5'-O-tosyl-2'-deoxythymidine
5'-toluenesulfonylthymidine
thymidine 5'-p-toluenesulfonate
Thymidine 5'-tosylate

MDL Number

MFCD08448698

FAQ

What are the physical and chemical properties of 5'-O-[(4-Methylphenyl)sulfonyl]thymidine (CAS: 7253-19-2)?

5'-O-[(4-Methylphenyl)sulfonyl]thymidine has a crystalline form and a molecular weight of approximately 339.35 g/mol. It is poorly soluble in water but soluble in organic solvents like ethanol and acetone. This compound is reactive towards nucleophilic substitution and can undergo hydrolysis under basic conditions. It is stable in neutral and acidic conditions.

How is 5'-O-[(4-Methylphenyl)sulfonyl]thymidine (CAS: 7253-19-2) typically synthesized?

5'-O-[(4-Methylphenyl)sulfonyl]thymidine is typically synthesized via a sulfonylation reaction of thymidine using a sulfonyl chloride derivative in the presence of a base. The reaction is carried out in an inert solvent, and the product has high selectivity and good yield.

What industries use 5'-O-[(4-Methylphenyl)sulfonyl]thymidine (CAS: 7253-19-2)?

5'-O-[(4-Methylphenyl)sulfonyl]thymidine is used in the pharmaceutical industry for its potential as an antiviral agent. It is also explored in the polymer industry for its stability and reactivity, and in sensor technology due to its biochemical properties.

What precautions should be taken when handling 5'-O-[(4-Methylphenyl)sulfonyl]thymidine (CAS: 7253-19-2)?

When handling 5'-O-[(4-Methylphenyl)sulfonyl]thymidine, it is essential to use personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a fume hood to minimize inhalation risks. Spills should be cleaned up carefully using appropriate absorbent materials. Always consult the Safety Data Sheet (SDS) for specific handling and disposal instructions.