9-[(2R,5S)-5-(Hydroxymethyl)tetrahydro-2-furanyl]-1,9-dihydro-6H-purin-6-one

Basic Information

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CAS Number

69655-05-6

Molecular Formula

C10H12N4O3

Molecular Weight

236.23 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

Basic Physical Properties

Melting Point

182°C

Boiling Point

586.5°C at 760 mmHg

Density

1.2917 (rough estimate)

Water Solubility

1-5 g/100 mL at 21 ºC

Flash Point

308.5 oC

Solubility

Soluble in DMSO or methanol

Refractive Index

-28 ° (C=0.34, H2O)

Specific Rotation

D25 -26.3° (c = 10 in water)

SMILES

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C1CC(OC1CO)N2C=NC3=C2N=CNC3=O

InChI

InChI=1S/C10H12N4O3/c15-3-6-1-2-7(17-6)14-5-13-8-9(14)11-4-12-10(8)16/h4-7,15H,1-3H2,(H,11,12,16)/t6-,7+/m0/s1

InChIKey

BXZVVICBKDXVGW-NKWVEPMBSA-N

LogP

-0.21050000000000008

pKa

9.12(at 25℃)

Topological Polar Surface Area

93.02999999999999 Å²

Hydrogen Bond Donor/Acceptor

2 / 7

Complexity

348

Safety Information

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Hazard Statement

H341 Suspected of causing genetic defects
Germ cell mutagenicity

H373 Causes damage to organs through prolonged or repeated exposure
Specific target organ toxicity, repeated exposure

Stability

Stable. Combustible. Incompatible with strong oxidizing agents.

Sensitiveness

Sensitive to moisture

Synonyms & References

English

Didanosinum (INN-Latin)
SR-05000001487-2
DDI and rIFN.alpha.2
2',3'-Dideoxyinosine, >=98% (HPLC)
NCGC00090691-14
Didanosinum [INN-Latin]
AKOS015963259
AKOS026750545
NCGC00390773-01
9-(2,3-Dideoxy-beta-D-ribofuranosyl)hypoxanthine
NC00197
Tox21_300575
2',3'-DIDEOXYINOSINE; Didanosine
HMS2095O08
2',3'-Dideoxyinosine & Granulocyte-macrophage colony-stimulating factor
SR-05000001487-1
KS-1049
DDI
2',3'-Dideoxyinosine & Interferon-.alpha.
9-(2,3-Dideoxy-beta-D-ribofuranosyl)-6-oxopurine
BP-58651
didanosine
9-((2R,5S)-5-Hydroxymethyl-tetrahydro-furan-2-yl)-1,9-dihydro-purin-6-one
Didanosine and Interferon-.alpha.-2
NCGC00090691-01
Z1546616193
NCGC00159514-04
69655-05-6
2', 3'-dideoxyinosine
HSDB 6548
MLS001424118

MDL Number

MFCD00077728

Customs Code

2942000000

FAQ

What is 9-[(2R,5S)-5-(Hydroxymethyl)tetrahydro-2-furanyl]-1,9-dihydro-6H-purin-6-one (CAS: 69655-05-6)?

9-[(2R,5S)-5-(Hydroxymethyl)tetrahydro-2-furanyl]-1,9-dihydro-6H-purin-6-one is a chemical compound with the CAS number 69655-05-6. It belongs to the purine class and contains a hydroxymethyl group attached to a tetrahydrofuran ring. This compound is known for its complex structure and is often used in specialized chemical applications. Its molecular formula is C11H14N4O3.

What are the main uses of 9-[(2R,5S)-5-(Hydroxymethyl)tetrahydro-2-furanyl]-1,9-dihydro-6H-purin-6-one (CAS: 69655-05-6)?

This compound is primarily used in pharmaceutical research, particularly in the development of nucleoside analogs and antiviral agents. It may also find applications in organic synthesis and as a building block for more complex molecules. Due to its structural features, it is of interest in medicinal chemistry and drug design.

Is 9-[(2R,5S)-5-(Hydroxymethyl)tetrahydro-2-furanyl]-1,9-dihydro-6H-purin-6-one (CAS: 69655-05-6) safe?

Safety of 9-[(2R,5S)-5-(Hydroxymethyl)tetrahydro-2-furanyl]-1,9-dihydro-6H-purin-6-one depends on its application and exposure conditions. As a research compound, it should be handled with care in a well-ventilated area. Protective gloves and goggles are recommended. Safety data sheets (SDS) should be consulted for detailed handling and disposal guidelines.

How should 9-[(2R,5S)-5-(Hydroxymethyl)tetrahydro-2-furanyl]-1,9-dihydro-6H-purin-6-one (CAS: 69655-05-6) be stored?

This compound should be stored in a cool, dry, and dark place, preferably at 2-8°C. It is sensitive to moisture and light, so it should be kept in a sealed, airtight container. Proper storage helps maintain its chemical stability and prolongs its shelf life. Always store away from incompatible substances and ensure good ventilation.