Methyl bromo(2-chlorophenyl)acetate

Basic Information

View in Editor

CAS Number

85259-19-4

Molecular Formula

C9H8BrClO2

Molecular Weight

263.52 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

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

281 ºC

Density

1.567

Flash Point

124 ºC

Refractive Index

1.5630 to 1.5670

SMILES

View in Editor

COC(=O)C(Br)c1ccccc1Cl

InChI

InChI=1S/C9H8BrClO2/c1-13-9(12)8(10)6-4-2-3-5-7(6)11/h2-5,8H,1H3

InChIKey

HMBUCZUZRQQJQD-UHFFFAOYSA-N

LogP

2.9490000000000016

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

187

Safety Information

View Safety Information

Hazard Statement

H290 May be corrosive to metals
Corrosive to Metals

H314 Causes severe skin burns and eye damage
Skin corrosion/irritation

Hazard Class

Class 8 Class 8

Synonyms & References

English

Methyl 2-bromo-2-(2-chlorophenyl)acetate
alpha-Bromo-2-chloro-phenylacetic acid methyl ester
Methyl α-Bromo-2-chlorophenylacetate
Methyl alpha-Bromo-2-chlorophenylacetate
2-Bromo-2-(2-chlorophenyl)acetic acid methyl ester
Methyl α-Bromo-2-chl
&alpha
ALPHA BROMO-2-CHLORO PHENYL ACETIC ACID
METHYL ESTER
α-Bromo-2-chlorophenylacetic Acid Methyl Ester
methyl 2-bromo-2-(2-chlorophenyl)acetate

MDL Number

MFCD08444353

Customs Code

2916399090

FAQ

What are the physical and chemical properties of Methyl bromo(2-chlorophenyl)acetate (CAS: 85259-19-4)?

Methyl bromo(2-chlorophenyl)acetate is a crystalline solid with a molecular weight of approximately 250.72 g/mol. It has a low solubility in water but is soluble in common organic solvents like ethanol and acetone. The compound is moderately reactive, especially towards nucleophiles and reducing agents. It can undergo nucleophilic substitution and electrophilic aromatic substitution reactions.

How is methyl bromo(2-chlorophenyl)acetate (CAS: 85259-19-4) typically synthesized?

Methyl bromo(2-chlorophenyl)acetate is synthesized through the bromination of methyl (2-chlorophenyl)acetate with an excess of bromine in the presence of a phase transfer catalyst. The reaction is carried out under anhydrous conditions to avoid side reactions. The yield is typically 80-85%, and the product is isolated by recrystallization.

What industries use methyl bromo(2-chlorophenyl)acetate (CAS: 85259-19-4)?

Methyl bromo(2-chlorophenyl)acetate is primarily used in the pharmaceutical industry for the synthesis of certain drug intermediates. It is also used in the polymer industry for modifying polymers and in the sensor industry for developing gas-sensing materials. Additionally, it has applications in semiconductor manufacturing for etching and cleaning processes.

What precautions should be taken when handling methyl bromo(2-chlorophenyl)acetate (CAS: 85259-19-4)?

Handling methyl bromo(2-chlorophenyl)acetate requires appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The substance should be handled in a well-ventilated area or a fume hood to avoid inhalation. Spills should be cleaned up immediately using appropriate absorbents, and the area should be flushed with water. Emergency response procedures and Material Safety Data Sheets (MSDS/SDS) should be readily accessible for reference in case of accidents.