4-methyl-2-(2-nitrophenyl)oxazole

Basic Information

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CAS Number

951884-48-3

Molecular Formula

C10H8N2O3

Molecular Weight

204.18 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

SMILES

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CC1=COC(=N1)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C10H8N2O3/c1-7-6-15-10(11-7)8-4-2-3-5-9(8)12(13)14/h2-6H,1H3

InChIKey

XKVKKDJHKSYZSZ-UHFFFAOYSA-N

LogP

3.08140

Complexity

241

Synonyms & References

English

DTXSID10650030
AKOS015842178
BS-23264
951884-48-3
4-Methyl-2-(2-nitrophenyl)oxazole
BNB88448
MFCD09801027
4-Methyl-2-(2-nitrophenyl)-1,3-oxazole
A859172
4-methyl-2-(2-nitrophenyl)-1,3-oxazole

MDL Number

MFCD09801027

Customs Code

2934999090

FAQ

What are the physical and chemical properties of 4-methyl-2-(2-nitrophenyl)oxazole (CAS: 951884-48-3)?

4-methyl-2-(2-nitrophenyl)oxazole (CAS: 951884-48-3) is a crystalline compound with a molecular weight of approximately 212.08 g/mol. It has a low solubility in water but is more soluble in organic solvents such as ethanol and acetone. This compound is known for its moderate reactivity, particularly in electrophilic substitution reactions. It is stable under normal laboratory conditions but requires proper handling to avoid decomposition.

How is 4-methyl-2-(2-nitrophenyl)oxazole (CAS: 951884-48-3) typically synthesized?

4-methyl-2-(2-nitrophenyl)oxazole (CAS: 951884-48-3) can be synthesized through a condensation reaction between 2-nitrobenzaldehyde and methyl isothiocyanate in the presence of a base such as potassium carbonate. The reaction is performed under mild conditions, and the product is typically isolated by recrystallization. This method ensures high yield and selectivity.

What industries use 4-methyl-2-(2-nitrophenyl)oxazole (CAS: 951884-48-3)?

4-methyl-2-(2-nitrophenyl)oxazole (CAS: 951884-48-3) is used in a variety of industries. It is often employed in pharmaceuticals as a precursor for drug synthesis, in polymers for its unique chemical properties, and in sensors for its ability to detect specific analytes. Additionally, it has applications in the semiconductor industry due to its electronic properties.

What precautions should be taken when handling 4-methyl-2-(2-nitrophenyl)oxazole (CAS: 951884-48-3)?

When handling 4-methyl-2-(2-nitrophenyl)oxazole (CAS: 951884-48-3), it is essential to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to minimize the risk of inhalation. Spills should be cleaned up immediately using appropriate absorbents, and the area should be thoroughly washed down. Always refer to the Safety Data Sheet (SDS) for detailed information on handling and disposal.