2-(Bromomethyl)-1,4-difluorobenzene

Basic Information

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CAS Number

85117-99-3

Molecular Formula

C7H5BrF2

Molecular Weight

207.02 g/mol

Chemical Classification

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

Boiling Point

28 °C

Density

1.609 g/mL at 25 °C

Refractive Index

n20/D 1.526(lit.)

SMILES

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Fc1ccc(F)c(CBr)c1

InChI

InChI=1S/C7H5BrF2/c8-4-5-3-6(9)1-2-7(5)10/h1-3H,4H2

InChIKey

ONWGSWNHQZYCFK-UHFFFAOYSA-N

LogP

2.859700000000001

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

108

Safety Information

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GHS Hazard Pictograms

H225

H314

Hazard Statement

H225 Highly Flammable liquid and vapor
Flammable liquids

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

Hazard Class

Class 8 Class 8

Synonyms & References

English

2-(Bromomethyl)-1,4-difluorobenzene
2,5-Difluorobenzyl bromide
α-Bromo-2,5-difluorotoluene

MDL Number

MFCD00009897

FAQ

What regulatory guidelines apply to 2-(Bromomethyl)-1,4-difluorobenzene (CAS: 85117-99-3)?

2-(Bromomethyl)-1,4-difluorobenzene (CAS: 85117-99-3) falls under the Chemicals of Very High Concern (SVHC) list under REACH. It is also classified under GHS as a category 1B carcinogen. FDA and EPA have specific guidelines for its handling and disposal to ensure environmental and occupational safety.

Are there alternatives to 2-(Bromomethyl)-1,4-difluorobenzene (CAS: 85117-99-3) in synthesis?

Alternative reagents like 2-(Methoxymethyl)-1,4-difluorobenzene or 2-(Phenylmethyl)-1,4-difluorobenzene can be used as alternatives in synthesis. These compounds offer similar structural features but with different functional groups, providing flexibility in chemical processes.

What is the market or research trend for 2-(Bromomethyl)-1,4-difluorobenzene (CAS: 85117-99-3)?

Research trends for 2-(Bromomethyl)-1,4-difluorobenzene (CAS: 85117-99-3) are focusing on its use in pharmaceuticals and agrochemicals due to its unique physical and chemical properties. Market trends indicate increasing demand in these sectors, driven by its potential as a key intermediate in synthetic routes.

How should waste containing 2-(Bromomethyl)-1,4-difluorobenzene (CAS: 85117-99-3) be handled?

Waste containing 2-(Bromomethyl)-1,4-difluorobenzene (CAS: 85117-99-3) should be collected in appropriate containers and treated as hazardous waste. It should be incinerated or disposed of professionally to minimize environmental impact and ensure compliance with REACH and local regulations.