Methyl 2-bromo-6-fluorobenzoate

Basic Information

View in Editor

CAS Number

820236-81-5

Molecular Formula

C8H6BrFO2

Molecular Weight

233.04 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

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Density

1.577±0.06 g/cm3 (20 ºC 760 Torr),

Flash Point

105.8±23.2 ºC,

SMILES

View in Editor

COC(=O)c1c(F)cccc1Br

InChI

InChI=1S/C8H6BrFO2/c1-12-8(11)7-5(9)3-2-4-6(7)10/h2-4H,1H3

InChIKey

TZQFXIYFLBBLQJ-UHFFFAOYSA-N

LogP

2.3748000000000005

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Synonyms & References

English

Methyl 2-bromo-6-fluorobenzoate
2-Bromo-6-fluorobenzoic acid methyl ester
Benzoic acid, 2-bromo-6-fluoro-, methyl ester
TZQFXIYFLBBLQJ-UHFFFAOYSA
methyl 2-bromo-6-fluorobenzoate

MDL Number

MFCD10000922

Customs Code

2916399090

FAQ

What regulatory guidelines apply to Methyl 2-bromo-6-fluorobenzoate (CAS: 820236-81-5)?

Methyl 2-bromo-6-fluorobenzoate (CAS: 820236-81-5) is subject to regulatory guidelines under the Global Harmonized System of Classification and Labelling of Chemicals (GHS), including classification as a hazardous substance. In the European Union, it falls under the Registration, Evaluation, Authorization and Restriction of Chemicals (REACH) regulation. Additionally, it may be regulated by the Food and Drug Administration (FDA) and Environmental Protection Agency (EPA) in the United States based on specific use scenarios.

Are there alternatives to Methyl 2-bromo-6-fluorobenzoate (CAS: 820236-81-5) in synthesis?

There are several alternatives to Methyl 2-bromo-6-fluorobenzoate (CAS: 820236-81-5) in synthesis, such as other brominated and fluorinated benzoates, or using different functional groups like chloro or cyano groups. Common alternatives include Methyl 2-chloro-6-fluorobenzoate, which can be used for similar chemical transformations in synthesis.

What is the market or research trend for Methyl 2-bromo-6-fluorobenzoate (CAS: 820236-81-5)?

The market and research trends for Methyl 2-bromo-6-fluorobenzoate (CAS: 820236-81-5) reflect increasing interest in fluoro- and bromo-substituted compounds due to their unique chemical properties. Research is focusing on their use in pharmaceuticals, agrochemicals, and materials science, with growing emphasis on sustainable and environmentally friendly synthetic routes.

How should waste containing Methyl 2-bromo-6-fluorobenzoate (CAS: 820236-81-5) be handled?

Waste containing Methyl 2-bromo-6-fluorobenzoate (CAS: 820236-81-5) should be collected in appropriate containers and handled according to local regulations. Incineration is a common method for disposal, but professional waste disposal services should be used to ensure compliance with environmental protection standards. Proper precautions include wearing protective gear and ensuring good ventilation during handling.