Methyl 2-bromobutanoate

Basic Information

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CAS Number

69043-96-5

Molecular Formula

C5H9BrO2

Molecular Weight

181.03 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

Water Treatment Chemicals Coagulants and Flocculants Inorganic Coagulants

Basic Physical Properties

Boiling Point

137-138 °C50 mm Hg

Density

1.573 g/mL at 25 °C

Flash Point

155 °F

Refractive Index

n20/D 1.452(lit.)

SMILES

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CCC(C(=O)OC)Br

InChI

InChI=1S/C5H9BrO2/c1-3-4(6)5(7)8-2/h4H,3H2,1-2H3

InChIKey

UFQQDNMQADCHGH-UHFFFAOYSA-N

LogP

1.3329

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

82.5

Safety Information

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Hazard Class

Class 8 Class 8

Synonyms & References

English

AM20090460
NS00045042
SCHEMBL532563
Methyl 2-bromobutanoate #
a-Bromobutanoic acid methyl ester
CS-W017174
Methyl 2-bromobutyrate
AKOS001270829
F2190-0282
AKOS016842317
2-Bromobutyric Acid Methyl Ester
EINECS 221-699-0
?2-Bromobutyric acid methyl ester
NSC-21974
InChI=1/C5H9BrO2/c1-3-4(6)5(7)8-2/h4H,3H2,1-2H
FT-0628433
methyl alpha-bromobutyrate
MFCD20622163
Q-201370
69043-96-5
Methyl bromobutyrate
2-Bromobutanoic acid methyl ester
Butanoic acid, 2-bromo-, methyl ester
B1462
NSC21974
2-bromo-butyric acid methyl ester
DTXSID50863122
AS-18287
2-Bromobutyricacidmethylester
Methyl-2-bromobutyrate
FT-0611545

MDL Number

MFCD00009666

FAQ

What is Methyl 2-bromobutanoate (CAS: 69043-96-5)?

Methyl 2-bromobutanoate is an organic compound with the CAS number 69043-96-5. It is a colorless or slightly yellow liquid with a bromine odor. The molecular formula is C6H10BrO2 and it has a boiling point of 125°C and a density of 1.34 g/cm³.

What are the main uses of Methyl 2-bromobutanoate (CAS: 69043-96-5)?

Methyl 2-bromobutanoate is primarily used as a brominating agent in organic synthesis. It is also utilized in the production of fragrances and flavorings, as an intermediate in the synthesis of pharmaceuticals, and in the rubber industry for vulcanization.

Is Methyl 2-bromobutanoate (CAS: 69043-96-5) safe?

Methyl 2-bromobutanoate is generally safe when handled with proper precautions. However, it is important to avoid inhalation and skin contact due to its irritant properties. Proper ventilation and personal protective equipment such as gloves and goggles should be used.

How should Methyl 2-bromobutanoate (CAS: 69043-96-5) be stored?

Methyl 2-bromobutanoate should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent exposure to moisture and air. Store it at room temperature (15-25°C) and avoid temperatures above 30°C to maintain its stability.