Ethyl 2-bromo-4-methyl-1,3-oxazole-5-carboxylate

Basic Information

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CAS Number

78451-13-5

Molecular Formula

C7H8BrNO3

Molecular Weight

234.05 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

281 ºC

Density

1.536

Flash Point

123 ºC

SMILES

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CCOC(=O)C1=C(N=C(O1)Br)C

InChI

InChI=1S/C7H8BrNO3/c1-3-11-6(10)5-4(2)9-7(8)12-5/h3H2,1-2H3

InChIKey

DNPOJRGNNVJCRZ-UHFFFAOYSA-N

LogP

1.92222

Topological Polar Surface Area

52.33 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

176

Synonyms & References

English

ethyl 2-bromo-4-methyl-1,3-oxazole-5-carboxylate
78451-13-5
AM9792
2-bromo-4-methyl-oxazole-5-carboxylic acid ethyl ester
EN300-352269
SB38753
AKOS015918613
A865025
DNPOJRGNNVJCRZ-UHFFFAOYSA-N
AS-39173
CS-0136181
MFCD12031295
FT-0726301
ethyl 2-bromo-4-methyloxazole-5-carboxylate
ethyl2-bromo-4-methyloxazole-5-carboxylate
SCHEMBL11164366
5-Oxazolecarboxylic acid, 2-bromo-4-methyl-, ethyl ester
DTXSID20509803
Ethyl 2-bromo-4-methyloxazole-5-carboxylate
LogP
2-bromo-4-methyl-5-Oxazolecarboxylic acid ethyl ester
ETHYL-2-BROMO-4-METHYL OXAZOLE-5-CARBOXYLATE
2-Bromo-4-methyl-oxazole-5-carboxylic acid ethyl ester

MDL Number

MFCD12031295

FAQ

What is Ethyl 2-bromo-4-methyl-1,3-oxazole-5-carboxylate (CAS: 78451-13-5)?

Ethyl 2-bromo-4-methyl-1,3-oxazole-5-carboxylate (CAS: 78451-13-5) is a organic compound with a molecular formula of C8H9BrNO3. It is a colorless liquid with a pungent odor. This compound is used in pharmaceuticals and as a reagent in organic synthesis.

What are the main uses of Ethyl 2-bromo-4-methyl-1,3-oxazole-5-carboxylate (CAS: 78451-13-5)?

Ethyl 2-bromo-4-methyl-1,3-oxazole-5-carboxylate (CAS: 78451-13-5) is primarily used as a reactant in the synthesis of other organic compounds, particularly in the development of pharmaceuticals and agrochemicals. It can also serve as a reagent in academic and industrial research.

Is Ethyl 2-bromo-4-methyl-1,3-oxazole-5-carboxylate (CAS: 78451-13-5) safe?

Ethyl 2-bromo-4-methyl-1,3-oxazole-5-carboxylate (CAS: 78451-13-5) can be hazardous due to its bromine content. Proper safety measures, including the use of gloves and goggles, should be taken. It should be stored in a well-ventilated area, away from heat and ignition sources, and protected from direct light.

How should Ethyl 2-bromo-4-methyl-1,3-oxazole-5-carboxylate (CAS: 78451-13-5) be stored?

Ethyl 2-bromo-4-methyl-1,3-oxazole-5-carboxylate (CAS: 78451-13-5) should be stored in a tightly sealed container, away from heat, moisture, and light. The storage should be in a cool, dry place and protected from temperature fluctuations that could affect its stability. It should be kept under ambient conditions unless specific temperature requirements are indicated by the manufacturer.