4-Bromo-3-methyl-1,2-oxazole

Basic Information

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CAS Number

101084-19-9

Molecular Formula

C4H4BrNO

Molecular Weight

161.99 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

Boiling Point

143-145 ºC

Flash Point

72.6±21.8 ºC,

Refractive Index

1.4742 (589.3 nm 20 ºC)

SMILES

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CC1=NOC=C1Br

InChI

InChI=1S/C4H4BrNO/c1-3-4(5)2-7-6-3/h2H,1H3

InChIKey

NXUGSYBTPQHKQB-UHFFFAOYSA-N

LogP

1.74552

Topological Polar Surface Area

26.03 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

68.7

Synonyms & References

English

SCHEMBL12777840
F2147-8093
EN300-217647
BEA08419
E79470
4-Bromo-3-methylisoxazole
Isoxazole, 4-bromo-3-methyl-
Isoxazole,4-bromo-3-methyl-
AM20210014
101084-19-9
Isoxazole, 4-bromo-3-methyl- (6CI)
NXUGSYBTPQHKQB-UHFFFAOYSA-N
AKOS027322034
A937259
SY265513
4-bromo-3-methyl-1,2-oxazole
MFCD28960568

MDL Number

MFCD28960568

FAQ

What is 4-Bromo-3-methyl-1,2-oxazole (CAS: 101084-19-9)?

4-Bromo-3-methyl-1,2-oxazole (CAS: 101084-19-9) is a heterocyclic aromatic compound with the molecular formula C5H5BrNO. It is a white crystalline solid with a distinctive odor. This compound is characterized by its bromine and methyl substituents on the oxazole ring.

What are the main uses of 4-Bromo-3-methyl-1,2-oxazole (CAS: 101084-19-9)?

4-Bromo-3-methyl-1,2-oxazole (CAS: 101084-19-9) is primarily used in organic synthesis as a starting material for other compounds. It can also be used in pharmaceutical research for developing certain classes of drugs. Additionally, it has applications in the preparation of dyes and pigments.

Is 4-Bromo-3-methyl-1,2-oxazole (CAS: 101084-19-9) safe?

4-Bromo-3-methyl-1,2-oxazole (CAS: 101084-19-9) is generally considered safe for laboratory use when handled with appropriate precautions. However, it is important to follow standard safety protocols, including the use of gloves and protective eyewear to prevent skin and eye contact. Exposure to high temperatures or direct sunlight should be avoided.

How should 4-Bromo-3-methyl-1,2-oxazole (CAS: 101084-19-9) be stored?

4-Bromo-3-methyl-1,2-oxazole (CAS: 101084-19-9) should be stored in a cool, dry place away from direct sunlight and heat sources. It is advisable to store the compound in a tightly sealed container to prevent degradation. Avoid storing it near oxidizing agents or other reactive materials.