2-Bromoadenine

Basic Information

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CAS Number

28128-25-8

Molecular Formula

C5H4BrN5

Molecular Weight

214.03 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

673.7°C at 760 mmHg

Density

2.14

Flash Point

254.7°C

Refractive Index

1.851

SMILES

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C1=NC2=NC(=NC(=C2N1)N)Br

InChI

InChI=1S/C5H4BrN5/c6-5-10-3(7)2-4(11-5)9-1-8-2/h1H,(H3,7,8,9,10,11)

InChIKey

CPZULIHZICLSQT-UHFFFAOYSA-N

LogP

0.6975999999999999

Topological Polar Surface Area

80.47999999999999 Å²

Hydrogen Bond Donor/Acceptor

3 / 5

Complexity

154

Synonyms & References

English

A819338
2-Bromo-9H-purin-6-amine
bromo adenine
FT-0753961
AKOS015900122
2-Bromoadenine
DTXSID80403959
2-bromo-7H-purin-6-amine
NSC-52757
NSC52757
SCHEMBL497198
28128-25-8
2-Bromo-7H-purin-6-amine
2-bromanyl-7H-purin-6-amine
6-AMINO-2-BROMOPURINE

MDL Number

MFCD12964279

Customs Code

2933990090

FAQ

What is 2-Bromoadenine (CAS: 28128-25-8)?

2-Bromoadenine is a chemical compound with the CAS number 28128-25-8. It is a derivative of adenine, containing a bromine atom at the 2-position. This compound is used as a research tool in biochemical and pharmaceutical studies due to its unique structural modifications.

What are the main uses of 2-Bromoadenine (CAS: 28128-25-8)?

2-Bromoadenine is primarily used in chemical synthesis and research, particularly in studying the effects of bromine substitution on nucleobase properties. It is also utilized in the development of selective inhibitors for certain enzymes and in the design of new drugs.

Is 2-Bromoadenine (CAS: 28128-25-8) safe?

2-Bromoadenine is generally safe when handled properly. However, it is important to follow all safety guidelines and wear appropriate personal protective equipment (PPE) to avoid skin contact and inhalation. Proper ventilation is also essential during use.

How should 2-Bromoadenine (CAS: 28128-25-8) be stored?

2-Bromoadenine should be stored in a cool, dry place away from heat and direct sunlight. It should be kept in a tightly sealed container made of appropriate material to prevent degradation. The storage area should have a temperature range of 15-25°C and a relative humidity below 60%. Handling should be done with care to avoid spills and contamination.