(2R,3R,4S,5R)-2-(2-amino-8-bromo-6-hydroxy-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol

Basic Information

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CAS Number

4016-63-1

Molecular Formula

C10H12BrN5O5

Molecular Weight

362.14 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

White to Yellow Solid

Melting Point

203°C

Boiling Point

774°Cat760mmHg

Density

2.62

Flash Point

421.9°C

Refractive Index

1.986

Specific Rotation

-50.2° (c=2 in NH4OH)

SMILES

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Nc1nc(O)c2nc(Br)n([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1

InChI

InChI=1S/C10H12BrN5O5/c11-9-13-3-6(14-10(12)15-7(3)20)16(9)8-5(19)4(18)2(1-17)21-8/h2,4-5,8,17-19H,1H2,(H3,12,14,15,20)/t2-,4-,5-,8-/m1/s1

InChIKey

ASUCSHXLTWZYBA-UMMCILCDSA-N

LogP

-1.5119000000000007

Topological Polar Surface Area

159.77000000000004 Å²

Hydrogen Bond Donor/Acceptor

6 / 10

Complexity

479

Safety Information

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Hazard Statement

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

8-Bromoguanosine
8-Bromoguanosine hydrate
8-Bromo-Guanosine
8-Bromoguanosine NEW
2-Amino-8-bromo-6-hydroxypurine riboside
8-Bromo-D-guanosine
Guanosine, 8-bromo-
2-amino-8-bromo-9-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-1H-purin-6(9H)-one
8 BrGuo
8-bromo guanosine
C10H12BrN5O5
8-bro-moguanosine
2-amino-8-bromo-9-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-1,9-dihydro-6H-purin-6-one
PubChem12690
KSC238K2T
ASUCSHXLTWZYBA-UMMCILCDSA-N
HG1301
BC003688
AB0031730
X4912
Q27458387
2-amino-8-bromo-9-[(2R,3R,4S,5R)-
2-amino-8-bromo-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6,9-dihydro-3H-purin-6-one

MDL Number

MFCD00037985

Customs Code

2934999090

FAQ

What is (2R,3R,4S,5R)-2-(2-amino-8-bromo-6-hydroxy-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol (CAS: 4016-63-1)?

(2R,3R,4S,5R)-2-(2-amino-8-bromo-6-hydroxy-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol is a complex organic compound with a unique chemical structure. It contains a purine ring with specific substituents, making it potentially useful in pharmaceutical research for its unique pharmacological properties.

What are the main uses of (2R,3R,4S,5R)-2-(2-amino-8-bromo-6-hydroxy-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol (CAS: 4016-63-1)?

The main uses of this compound include its potential application in pharmaceutical research, particularly in developing new drugs with specific biological activities. It may also be used in laboratory settings for research purposes.

Is (2R,3R,4S,5R)-2-(2-amino-8-bromo-6-hydroxy-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol (CAS: 4016-63-1) safe?

The safety of this compound depends on the specific context of use. It is important to follow safety guidelines and use appropriate protective measures, such as wearing gloves and goggles, to minimize exposure. Further research and testing are ongoing to fully understand its safety profile.

How should (2R,3R,4S,5R)-2-(2-amino-8-bromo-6-hydroxy-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol (CAS: 4016-63-1) be stored?

This compound should be stored in a cool, dry place away from direct sunlight. Use a tightly sealed container to prevent degradation. Maintain a temperature range of 15-25°C and avoid exposure to moisture and light to ensure stability and safety.