Methyl 2-bromo-6-chlorobenzoate

Basic Information

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CAS Number

685892-23-3

Molecular Formula

C8H6BrClO2

Molecular Weight

249.49 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

SMILES

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COC(=O)C1=C(C=CC=C1Br)Cl

InChI

InChI=1S/C8H6BrClO2/c1-12-8(11)7-5(9)3-2-4-6(7)10/h2-4H,1H3

InChIKey

XSNZTSBNXMQBRI-UHFFFAOYSA-N

LogP

2.889100000000001

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

174

Synonyms & References

English

2-BROMO-6-CHLOROBENZOIC ACID METHYL ESTER
CS-0094451
SY063558
Methyl 2-bromo-6-chlorobenzoate, 98%
A9124
XSNZTSBNXMQBRI-UHFFFAOYSA-N
methyl2-bromo-6-chlorobenzoate
Methyl-2-bromo-6-chlorobenzoate
AKOS004115261
SCHEMBL852447
J-521969
Benzoic acid, 2-bromo-6-chloro-, methyl ester
DTXSID10374926
MB02960
methyl 2-bromo-6-chlorobenzoate
MFCD03789160
FT-0755841
AM83025
AS-19882
685892-23-3
Methyl 2-bromo-6-chlorobenzoate
METHYL-2-BROMO-6-CHLOROBENZOATE
2-Brom-6-chlor-benzoesaeure-methylester
2-bromo-6-chloro-benzoic acid methyl ester
methyl 2-acetyl-6-chlorobenzoate
PubChem12094
RP28866
AS03619
5-bromo-2-(tert-butylsulfonyl)pyridine
SY0
methyl 2-bromo-6-chloro-benzoate

MDL Number

MFCD03789160

Customs Code

2916399090

FAQ

What regulatory guidelines apply to Methyl 2-bromo-6-chlorobenzoate (CAS: 685892-23-3)?

Methyl 2-bromo-6-chlorobenzoate (CAS: 685892-23-3) falls under the classification of a hazardous chemical according to the Globally Harmonized System of Classification and Labeling of Chemicals (GHS). It is regulated by the REACH regulations in the EU, which requires manufacturers and importers to register chemicals if they are manufactured or imported in quantities of 1 ton or more per year. In the US, the Environmental Protection Agency (EPA) oversees the use and disposal of such chemicals, and the Food and Drug Administration (FDA) may have specific requirements for its use in pharmaceuticals or food-related applications.

Are there alternatives to Methyl 2-bromo-6-chlorobenzoate (CAS: 685892-23-3) in synthesis?

Alternatives to Methyl 2-bromo-6-chlorobenzoate (CAS: 685892-23-3) in synthesis include other benzoic acid derivatives such as 2-chloro-6-fluorobenzoic acid and 2-bromo-6-methoxybenzoic acid. These can be used as precursors depending on the desired final product. Other common substitute solutions include the use of isomers or analogs of the compound, which can offer similar functionalities but with varying reactivity and toxicity profiles.

What is the market or research trend for Methyl 2-bromo-6-chlorobenzoate (CAS: 685892-23-3)?

The market for Methyl 2-bromo-6-chlorobenzoate (CAS: 685892-23-3) is driven by its applications in pharmaceuticals, pesticides, and organic synthesis. Research trends are focusing on its use as a building block in the development of new drugs and agrochemicals. Recent studies are exploring its potential in drug discovery for treating various diseases, including cancer. The market is also witnessing a shift towards greener and more sustainable alternatives, which could influence the demand for this compound in the future.

How should waste containing Methyl 2-bromo-6-chlorobenzoate (CAS: 685892-23-3) be handled?

Waste containing Methyl 2-bromo-6-chlorobenzoate (CAS: 685892-23-3) should be managed according to hazardous waste regulations. It is recommended to collect waste in sealed containers and dispose of it through a licensed hazardous waste disposal service. Environmental protection precautions include proper labeling of the waste, avoiding contact with skin and eyes, and ensuring that waste is not released into the environment. Incineration is a common method of disposal, but it should be conducted under controlled conditions to minimize the release of harmful chemicals into the atmosphere.