9-((2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-9H-purin-6-ol

Basic Information

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CAS Number

80049-87-2

Molecular Formula

C10H11FN4O4

Molecular Weight

270.22 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 Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

White to Yellow Solid

Boiling Point

682.1°C at 760 mmHg

Density

2.01±0.1 g/cm3 (20 ºC 760 Torr),

Flash Point

366.3°C

Refractive Index

1.809

SMILES

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C1=NC2=C(C(=O)N1)N=CN2C3C(C(C(O3)CO)O)F

InChI

InChI=1S/C10H11FN4O4/c11-5-7(17)4(1-16)19-10(5)15-3-14-6-8(15)12-2-13-9(6)18/h2-5,7,10,16-17H,1H2,(H,12,13,18)/t4-,5-,7-,10-/m1/s1

InChIKey

NRVOTDBYJXFINS-QYYRPYCUSA-N

LogP

-0.8794000000000004

Topological Polar Surface Area

113.52000000000001 Å²

Hydrogen Bond Donor/Acceptor

3 / 8

Complexity

409

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

Inosine,2'-deoxy-2'-fluoro-
MFCD09750860
DTXSID90230051
SCHEMBL9132895
CHEMBL3143525
2'-Dfin
2'-deoxy-2'-fluoro-inosine
SCHEMBL1061428
2'-Deoxy-2'-fluoroinosine
9-((2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-9H-purin-6-ol
A900947
AKOS037644236
9-(3-Fluoro-4-hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-1,9-dihydro-purin-6-one
Inosine, 2'-deoxy-2'-fluoro-
HG1193
2'-Deoxy-2'-fluoro-D-inosine
C10H11FN4O4
9-(2-Deoxy-2-fluoro-beta-D-ribofuranosyl)hypoxanthine
80049-87-2
9-[(2R,3R,4R,5R)-3-FLUORO-4-HYDROXY-5-(HYDROXYMETHYL)OXOLAN-2-YL]-1H-PURIN-6-ONE
AS-49383
2'-FLUORO-2'-DEOXYINOSINE
9-(2-Deoxy-2-fluoro-beta-D-ribofuranosyl)hypoxanthine;9-((2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-9H-purin-6-ol;2'-FLUORO-2'-DEOXYINOSINE
9-[(2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1H-purin-6-one
NRVOTDBYJXFINS-QYYRPYCUSA-N
9-[(2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-9H-purin-6-ol
2'-DEOXY-2'-FLUOROINOSINE
9-[(2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one
Inosine,2'-deoxy-2'-fluoro
2′-Deoxy-2′-fluoroinosine

MDL Number

MFCD09750860

Customs Code

2934999090

FAQ

What is 9-((2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-9H-purin-6-ol (CAS: 80049-87-2)?

9-((2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-9H-purin-6-ol, also known as PF-06700841, is a purine derivative with a unique molecular structure. It exhibits pharmacological properties that make it a promising candidate in the field of medicinal chemistry, particularly in the development of new drugs for various diseases.

What are the main uses of 9-((2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-9H-purin-6-ol (CAS: 80049-87-2)?

This compound is primarily used in pharmaceutical research as a novel therapeutic agent. It has shown potential in treating certain diseases such as cancer and viral infections due to its specific biological activity. Further clinical trials are ongoing to explore its full therapeutic potential.

Is 9-((2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-9H-purin-6-ol (CAS: 80049-87-2) safe?

While 9-((2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-9H-purin-6-ol is generally considered safe under controlled conditions, it is important to follow all safety protocols during handling and use. Proper personal protective equipment should be worn, and it should be stored away from heat and direct sunlight.

How should 9-((2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-9H-purin-6-ol (CAS: 80049-87-2) be stored?

This compound should be stored in a cool, dry place, away from direct sunlight and heat sources. It is recommended to keep it in a tightly sealed container to prevent degradation and contamination. Stability studies should be conducted to determine the exact storage conditions for optimal shelf life.