4-Bromo-N-methyl-2-pyrimidinamine

Basic Information

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CAS Number

1209458-16-1

Molecular Formula

C5H6BrN3

Molecular Weight

188.03 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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CNc1nccc(Br)n1

InChI

InChI=1S/C5H6BrN3/c1-7-5-8-3-2-4(6)9-5/h2-3H,1H3,(H,7,8,9)

InChIKey

ZODAKPDTWGOEAC-UHFFFAOYSA-N

LogP

1.2808

Topological Polar Surface Area

37.81 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

88.3

Synonyms & References

English

4-Bromo-N-methylpyrimidin-2-amine
4-?bromo-?N-?methyl-2-?Pyrimidinamine
QC-5602
4-Bromo-N-methyl-2-pyrimidinamine
4-Bromo-2-(methylamino)pyrimidine
RP24798
MB13471
FCH1153296
AX8209003
AB0035173
ST24028968
X9458

MDL Number

MFCD13193672

Customs Code

2933599090

FAQ

What are the physical and chemical properties of 4-Bromo-N-methyl-2-pyrimidinamine (CAS: 1209458-16-1)?

4-Bromo-N-methyl-2-pyrimidinamine (CAS: 1209458-16-1) is a crystalline solid with a molecular weight of approximately 226.03 g/mol. It has a high solubility in polar solvents such as methanol and acetonitrile. The compound reacts readily with nucleophiles due to the presence of the bromo and amine groups. It is stable under normal conditions but can be sensitive to moisture and air exposure.

How is 4-Bromo-N-methyl-2-pyrimidinamine (CAS: 1209458-16-1) typically synthesized?

4-Bromo-N-methyl-2-pyrimidinamine is typically synthesized via the reaction of 2-methyl-4-bromopyrimidine with methylamine in the presence of a base like sodium hydroxide. The process yields the desired product with good selectivity and moderate to high yield, depending on the reaction conditions.

What industries use 4-Bromo-N-methyl-2-pyrimidinamine (CAS: 1209458-16-1)?

4-Bromo-N-methyl-2-pyrimidinamine (CAS: 1209458-16-1) is used in the pharmaceutical industry for the synthesis of certain drug candidates. It is also utilized in the sensor technology sector for developing gas sensors and in semiconductor manufacturing for specific applications requiring precise chemical functionalities.

What precautions should be taken when handling 4-Bromo-N-methyl-2-pyrimidinamine (CAS: 1209458-16-1)?

When handling 4-Bromo-N-methyl-2-pyrimidinamine (CAS: 1209458-16-1), it is essential to wear appropriate personal protective equipment (PPE) such as safety goggles, gloves, and a laboratory coat. The compound should be handled in a well-ventilated area or a fume hood to minimize exposure to air and moisture. Spills should be cleaned up using appropriate absorbents, and the area should be thoroughly washed down. Always refer to the Safety Data Sheet (SDS) for detailed handling and disposal information.