1-Bromo-2-(bromomethyl)-4,5-dimethoxybenzene

Basic Information

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CAS Number

53207-00-4

Molecular Formula

C9H10Br2O2

Molecular Weight

309.99 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

White to Yellow Solid

Melting Point

84.0-85.5 ºC

Boiling Point

320.6±37.0 ºC (760 Torr),

Density

1.692±0.06 g/cm3 (20 ºC 760 Torr),

Flash Point

129.6±25.0 ºC,

SMILES

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COc1cc(CBr)c(cc1OC)Br

InChI

InChI=1S/C9H10Br2O2/c1-12-8-3-6(5-10)7(11)4-9(8)13-2/h3-4H,5H2,1-2H3

InChIKey

PAJNRELOTRXFAQ-UHFFFAOYSA-N

LogP

3.361200000000002

Topological Polar Surface Area

18.46 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

2-Bromo-4,5-dimethoxybenzyl bromide
Benzene, 1-bromo-2-(bromomethyl)-4,5-dimethoxy-
5-Bromo-4-(bromomethyl)-1,2-dimethoxybenzene
1-Bromo-2-(bromomethyl)-4,5-dimethoxybenzene
2-Bromo-4-5-dimethoxybenzyl-bromide
1-bromo-2-bromomethyl-4,5-dimethoxybenzene
2-bromo-3,4-dimethoxybenzyl bromide
1-bromo-2-(bromomethyl)-4,5-dimethoxybenzene

MDL Number

MFCD02727713

Customs Code

2909309090

FAQ

What regulatory guidelines apply to 1-Bromo-2-(bromomethyl)-4,5-dimethoxybenzene (CAS: 53207-00-4)?

1-Bromo-2-(bromomethyl)-4,5-dimethoxybenzene (CAS: 53207-00-4) falls under the scope of the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) and is classified as a hazardous chemical. It must comply with REACH regulations for registration, evaluation, authorization, and restriction of chemicals in the EU. Additionally, the FDA and EPA have specific requirements for the handling and reporting of such substances in the US, including environmental and occupational health considerations.

Are there alternatives to 1-Bromo-2-(bromomethyl)-4,5-dimethoxybenzene (CAS: 53207-00-4) in synthesis?

While 1-Bromo-2-(bromomethyl)-4,5-dimethoxybenzene (CAS: 53207-00-4) is a specific compound, alternative reagents such as bromoacetophenone or similar ortho-disubstituted bromobenzene derivatives can be used in synthesis. Researchers often explore synthetic alternatives to achieve similar functionality while potentially reducing the complexity or reactivity of the starting materials.

What is the market or research trend for 1-Bromo-2-(bromomethyl)-4,5-dimethoxybenzene (CAS: 53207-00-4)?

The market for 1-Bromo-2-(bromomethyl)-4,5-dimethoxybenzene (CAS: 53207-00-4) is primarily driven by its use in organic synthesis and as a precursor in pharmaceutical and agrochemical industries. Research trends include the development of greener and more sustainable synthesis methods, aligning with increasing concerns about environmental impact. There is also an ongoing exploration of its applications in medicinal chemistry and material science.

How should waste containing 1-Bromo-2-(bromomethyl)-4,5-dimethoxybenzene (CAS: 53207-00-4) be handled?

Waste containing 1-Bromo-2-(bromomethyl)-4,5-dimethoxybenzene (CAS: 53207-00-4) should be collected in appropriate sealed containers and handled according to the guidelines of the Globally Harmonized System (GHS). It should be neutralized or incinerated in a professional facility to avoid environmental contamination. Proper disposal should be conducted in compliance with local and national regulations, ensuring the safety of both the environment and public health.