6-Chloro-9-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-9H-purin-2-amine

Basic Information

View in Editor

CAS Number

848695-25-0

Molecular Formula

C14H15ClN6O

Molecular Weight

318.77 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

Melting Point

192-193℃

Density

1.50

SMILES

View in Editor

Cc1cnc(c(c1OC)C)Cn2cnc3c2nc(nc3Cl)N

InChI

InChI=1S/C14H15ClN6O/c1-7-4-17-9(8(2)11(7)22-3)5-21-6-18-10-12(15)19-14(16)20-13(10)21/h4,6H,5H2,1-3H3,(H2,16,19,20)

InChIKey

QULDDKSCVCJTPV-UHFFFAOYSA-N

LogP

2.13064

Topological Polar Surface Area

91.74 Å²

Hydrogen Bond Donor/Acceptor

2 / 7

Complexity

388

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H320 Causes eye irritation
Serious eye damage/eye irritation

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

Synonyms & References

English

6-Chloro-9-((4-methoxy-3,5-dimethylpyridin-2-yl)methyl)-9H-purin-2-amine
BIIB 021
9H-Purin-2-amine, 6-chloro-9-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-
BIIB-021
CNF2024
CNF-2024
BIIB021
6-Chloro-9-[(4-Methoxy-3,5-Dimethylpyridin-2-Yl)methyl]-9h-Purin-2-Amine
851B9FQ7Q0
CNF 2024
AK104952
6-Chloro-9-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-9h-purin-2-amine
6-chloro-9-((4-methoxy-3,5-dimethyl-2-pyridinyl)methyl)-9h-purin-2-amine
6-chloro-9-(4-methoxy-3,5-dimethyl-pyridin-2-ylmethyl)-9H-purin-2-ylamine
94M
3qdd

MDL Number

MFCD15528939

FAQ

What are the physical and chemical properties of 6-Chloro-9-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-9H-purin-2-amine (CAS: 848695-25-0)?

6-Chloro-9-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-9H-purin-2-amine (CAS: 848695-25-0) crystallizes in the form of white or off-white powder. Its molecular weight is approximately 443.25 g/mol. It has limited solubility in water, but good solubility in organic solvents such as methanol and acetonitrile. Chemically, it is stable under normal conditions, but can undergo hydrolysis in strong acidic or basic environments. It is slightly reactive towards nucleophiles.

How is 6-Chloro-9-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-9H-purin-2-amine (CAS: 848695-25-0) typically synthesized?

6-Chloro-9-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-9H-purin-2-amine (CAS: 848695-25-0) can be synthesized via multiple routes, including a multi-step process involving the coupling of 6-chloropurine and 4-methoxy-3,5-dimethyl-2-pyridine methylamine. The reaction typically requires the use of a suitable catalyst and proceeds with good yield. The synthetic route can be optimized to achieve high purity and selectivity.

What industries use 6-Chloro-9-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-9H-purin-2-amine (CAS: 848695-25-0)?

6-Chloro-9-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-9H-purin-2-amine (CAS: 848695-25-0) is primarily used in the pharmaceutical industry for the development of anti-inflammatory and anti-allergic drugs. It is also explored in sensor technology for its unique chemical properties.

What precautions should be taken when handling 6-Chloro-9-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-9H-purin-2-amine (CAS: 848695-25-0)?

Proper handling of 6-Chloro-9-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-9H-purin-2-amine (CAS: 848695-25-0) requires the use of personal protective equipment (PPE) such as gloves, goggles, and lab coats. It should be stored in a cool, dry place, away from direct sunlight and heat sources. In case of a spill, it is recommended to use appropriate absorbent materials and dispose of them according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed safety information.