2,6-Dichloro-9-(beta-D-ribofuranosyl)-9H-purine

Basic Information

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CAS Number

13276-52-3

Molecular Formula

C10H10Cl2N4O4

Molecular Weight

321.12 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

152-158°C

Boiling Point

589.3°C at 760 mmHg

Specific Rotation

-19.5° (c=1, MeOH)

SMILES

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C1=NC2=C(N1C3C(C(C(O3)CO)O)O)N=C(N=C2Cl)Cl

InChI

InChI=1S/C10H10Cl2N4O4/c11-7-4-8(15-10(12)14-7)16(2-13-4)9-6(19)5(18)3(1-17)20-9/h2-3,5-6,9,17-19H,1H2/t3-,5-,6-,9-/m1/s1

InChIKey

HJXWZGVMHDPCRS-UUOKFMHZSA-N

LogP

-0.25540000000000007

Topological Polar Surface Area

113.52000000000001 Å²

Hydrogen Bond Donor/Acceptor

3 / 8

Complexity

368

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

2,6-Dichloropurine riboside
AS-13694
AMY27185
2,6-Dichloropurine-9- beta -D-riboside
2,6-Dichloropurine-9-?-D-riboside
(2R,3R,4S,5R)-2-[2,6-bis(chloranyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
AKOS015895355
(2R,3R,4S,5R)-2-(2,6-Dichloro-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
SCHEMBL638999
9H-Purine, 2,6-dichloro-9-beta-D-ribofuranosyl-
2,6-Dichloropurineriboside
A806494
(2R,3R,4S,5R)-2-(2,6-dichloropurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
13276-52-3
(2R,3R,4S,5R)-2-(2,6-dichloro-9-purinyl)-5-(hydroxymethyl)oxolane-3,4-diol
C10H10Cl2N4O4
CS-W005824
2,6-dichloropurine-9-beta-d-riboside
PD133753
2,6-Dichloro-9H-purine Riboside
F11649
MFCD03411342
2,6-Dichloropurine-9-β-D-riboside
2,6-Dichloropurine r
2,6-DICHLOROPURINE RIBO
2,6-Dichloropurine Ribose
2,6-dichloropuine nuceotide
2,6-Dichloropurine-9--D-riboside
2,6-Dichloropurine-9-b-D-riboside
2,6-DICHLOROPURINE-9-BETA-D-RIBOSIDE
2, 6-DICHLOROPURINE RIBOSIDE (2,6DClPR)

MDL Number

MFCD03411342

Customs Code

2934999090

FAQ

What is 2,6-Dichloro-9-(beta-D-ribofuranosyl)-9H-purine (CAS: 13276-52-3)?

2,6-Dichloro-9-(beta-D-ribofuranosyl)-9H-purine is a purine derivative with the CAS number 13276-52-3. It contains a purine ring with a beta-D-ribofuranosyl group attached at position 9, and two chlorine atoms substituting at positions 2 and 6. This compound has anti-cancer and anti-viral properties due to its structural similarity to nucleic acid bases.

What are the main uses of 2,6-Dichloro-9-(beta-D-ribofuranosyl)-9H-purine (CAS: 13276-52-3)?

2,6-Dichloro-9-(beta-D-ribofuranosyl)-9H-purine is primarily used in the development of antiviral and antineoplastic drugs. It is a key intermediate in synthesizing nucleoside analogues for treating viral infections and cancers. It is also used in biochemical and medical research for studying nucleic acid metabolism and anti-viral mechanisms.

Is 2,6-Dichloro-9-(beta-D-ribofuranosyl)-9H-purine (CAS: 13276-52-3) safe?

2,6-Dichloro-9-(beta-D-ribofuranosyl)-9H-purine is generally safe when used under controlled laboratory conditions and with appropriate personal protective equipment. However, it can be toxic if ingested or inhaled in high concentrations. Proper handling, including wearing gloves and a lab coat, is essential to prevent skin contact and inhalation. Ensure good ventilation in the work area and dispose of waste in accordance with local regulations.

How should 2,6-Dichloro-9-(beta-D-ribofuranosyl)-9H-purine (CAS: 13276-52-3) be stored?

2,6-Dichloro-9-(beta-D-ribofuranosyl)-9H-purine should be stored in a cool, dry place away from direct sunlight and heat sources. Keep the container tightly sealed to prevent moisture and air exposure. Store it at room temperature, preferably between 15-25°C. Use a dark-colored container to minimize light exposure, which can affect the compound's stability. Keep it out of reach of children and unauthorized personnel, and store it in a secure location to prevent accidental exposure or theft.