5-(3-Bromophenyl)-1,2-oxazole

Basic Information

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CAS Number

7064-33-7

Molecular Formula

C9H6BrNO

Molecular Weight

224.06 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

Melting Point

66 °C

Boiling Point

320.7°Cat760mmHg

Density

1.524

Flash Point

147.7°C

Refractive Index

1.643

SMILES

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C1=CC(=CC(=C1)Br)C2=CC=NO2

InChI

InChI=1S/C9H6BrNO/c10-8-3-1-2-7(6-8)9-4-5-11-12-9/h1-6H

InChIKey

RVTONCSWDXJDIN-UHFFFAOYSA-N

LogP

3.1041000000000007

Topological Polar Surface Area

26.03 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

154

Safety Information

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Hazard Statement

Synonyms & References

English

MFCD02183531
BS-24526
5-(3-Bromophenyl)isoxazole, AldrichCPR
5-(3-Bromophenyl)isoxazole
A866581
AKOS009159202
Isoxazole,5-(3-bromophenyl)-
5-(3-bromophenyl)-1,2-oxazole
7064-33-7
FT-0703773
J-516158
D95993
CS-0187809
DTXSID70370828
SCHEMBL2278361

MDL Number

MFCD02183531

Customs Code

2934999090

FAQ

What regulatory guidelines apply to 5-(3-Bromophenyl)-1,2-oxazole (CAS: 7064-33-7)?

5-(3-Bromophenyl)-1,2-oxazole (CAS: 7064-33-7) is regulated under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS) as a hazardous chemical. It falls under REACH regulations in the European Union, requiring registration with the European Chemicals Agency. In the United States, FDA and EPA have specific guidelines for the handling and disposal of this compound. Compliance with these regulations is essential to ensure safety and environmental protection.

Are there alternatives to 5-(3-Bromophenyl)-1,2-oxazole (CAS: 7064-33-7) in synthesis?

Several alternatives can be considered in the synthesis of 5-(3-Bromophenyl)-1,2-oxazole (CAS: 7064-33-7), including 5-(3-Fluorophenyl)-1,2-oxazole and 5-(3-Iodophenyl)-1,2-oxazole. Isomeric oxazoles and other heterocyclic compounds may also serve as viable alternatives depending on the specific application. It is important to evaluate these alternatives based on reactivity, cost, and environmental impact.

What is the market or research trend for 5-(3-Bromophenyl)-1,2-oxazole (CAS: 7064-33-7)?

The market for 5-(3-Bromophenyl)-1,2-oxazole (CAS: 7064-33-7) is growing due to its applications in pharmaceuticals and agrochemicals. Research is focusing on the development of new derivatives and the exploration of its potential in medicinal chemistry. Market trends indicate increasing demand for this compound, driven by its utility in drug discovery and synthesis of bioactive molecules.

How should waste containing 5-(3-Bromophenyl)-1,2-oxazole (CAS: 7064-33-7) be handled?

Waste containing 5-(3-Bromophenyl)-1,2-oxazole (CAS: 7064-33-7) should be collected in appropriate containers and stored in a well-ventilated area. It is crucial to follow local regulations for hazardous waste disposal. Professional waste disposal services are recommended to ensure compliance with safety and environmental standards. Proper incineration or chemical neutralization methods should be used to dispose of the waste, minimizing environmental impact.