9-(2-bromoethyl)purin-6-amine

Basic Information

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CAS Number

68217-74-3

Molecular Formula

C7H8BrN5

Molecular Weight

242.08 g/mol

Chemical Classification

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

Boiling Point

441°C at 760 mmHg

SMILES

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C1=NC(=C2C(=N1)N(C=N2)CCBr)N

InChI

InChI=1S/C7H8BrN5/c8-1-2-13-4-12-5-6(9)10-3-11-7(5)13/h3-4H,1-2H2,(H2,9,10,11)

InChIKey

XWQMXSNGFXQZDR-UHFFFAOYSA-N

LogP

0.8034000000000002

Topological Polar Surface Area

69.62 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

178

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

DTXSID10218391
SY123870
FT-0718921
F30095
MFCD00204182
CS-0035802
9H-Purin-6-amine, 9-(2-bromoethyl)-
AS-48262
SCHEMBL218588
9-(2-Bromoethyl)adenine
9-(2-bromoethyl)-9h-purin-6-amine
9-(2-bromoethyl)purin-6-amine
9-(2-bromoethyl)ade-nine
68217-74-3
6-AMINO-9-(2-BROMOETHYL)-9H-PURINE
AKOS016846211
9-(2-Bromoethyl)-9H-purin-6-amine
6‐AMINO‐9‐(2‐BROMOETHYL)‐9H‐PURINE
9-(2-bromoethyl)adenine
6-amino-9-(2-bromoethyl)-9H-purine
9-(2-bromoethyl)-9H-6-purinamine
9-(2-bromoethyl)-adenine
9H-Purin-6-amine,9-(2-bromoethyl)
FCH1330805
BC637797
AK135608
AX8111494
P19200
9-(2-bromoethyl)-9H-purin-6-amine

MDL Number

MFCD00204182

Customs Code

2933990090

FAQ

What is 9-(2-bromoethyl)purin-6-amine (CAS: 68217-74-3)?

9-(2-bromoethyl)purin-6-amine (CAS: 68217-74-3) is a purine derivative with a 2-bromoethyl substituent at position 9. It is a white or off-white crystalline solid with a molecular formula of C10H12BrN4O. It has a melting point of 150-152°C and is slightly soluble in water. This compound is used in various applications, including pharmaceuticals and research.

What are the main uses of 9-(2-bromoethyl)purin-6-amine (CAS: 68217-74-3)?

9-(2-bromoethyl)purin-6-amine (CAS: 68217-74-3) is primarily used in pharmaceutical research and development as a potential drug candidate. It serves as a tool compound in biological assays and can also be utilized for its antiviral and anticancer properties. Additionally, it finds use in academic and industrial research for studying biochemical pathways and molecular interactions.

Is 9-(2-bromoethyl)purin-6-amine (CAS: 68217-74-3) safe?

9-(2-bromoethyl)purin-6-amine (CAS: 68217-74-3) is generally considered safe when handled properly. However, it should be used with caution due to its reactive nature and potential for skin irritation. Protective measures include wearing gloves, goggles, and a lab coat. Ensure good ventilation and avoid contact with skin and eyes. Storage should be in a cool, dry place away from direct sunlight.

How should 9-(2-bromoethyl)purin-6-amine (CAS: 68217-74-3) be stored?

9-(2-bromoethyl)purin-6-amine (CAS: 68217-74-3) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in tightly sealed containers to prevent moisture absorption. Store it in a well-ventilated area and avoid contact with incompatible materials such as strong acids or bases. Maintain a temperature range of 15-25°C for optimal stability.