2-Bromo-1,4-dimethylbenzene

Basic Information

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CAS Number

553-94-6

Molecular Formula

C8H9Br

Molecular Weight

185.06 g/mol

Chemical Classification

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

9-10 °C

Boiling Point

201°C

Refractive Index

n20/D 1.550(lit.)

SMILES

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CC1=CC(=C(C=C1)C)Br

InChI

InChI=1S/C8H9Br/c1-6-3-4-7(2)8(9)5-6/h3-5H,1-2H3

InChIKey

QXISTPDUYKNPLU-UHFFFAOYSA-N

LogP

3.065940000000001

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

90.6

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

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

Sensitiveness

light-sensitive

Synonyms & References

English

QXISTPDUYKNPLU-UHFFFAOYSA-
SY005952
553-94-6
1-bromo-2,5-dimethyl benzene
Benzene, 2-bromo-1,4-dimethyl-
1,4-Dimethyl-2-bromobenzene
2-bromo-rho-xylene
FT-0611610
DTXSID9060289
F8889-9367
2-Bromo-p-xylene
EN300-20071
2-Bromo-1,4-xylene
MFCD00000074
A8021
AKOS000202444
NS00033312
2-bromo-1,4-dimethyl-benzene
2,5-Dimethylphenyl bromide
CS-W016967
2,5-Dimethylbromobenzene
J-802069
Monobromo-p-Xylene
2-bromo p-xylene
p-Xylene, 2-bromo-
B0997
InChI=1/C8H9Br/c1-6-3-4-7(2)8(9)5-6/h3-5H,1-2H3
2,5-Xylyl bromide
2-Bromo-1,4-dimethylbenzene
1-Bromo-2,5-dimethylbenzene
Bromo-p-xylene

MDL Number

MFCD00000074

Customs Code

2903999090

FAQ

What regulatory guidelines apply to 2-Bromo-1,4-dimethylbenzene (CAS: 553-94-6)?

2-Bromo-1,4-dimethylbenzene (CAS: 553-94-6) is subject to regulatory guidelines under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), REACH regulations in the European Union, and FDA/EPA requirements for chemical manufacturing and handling. It is important to comply with specific handling, storage, and disposal guidelines to ensure safety and environmental protection.

Are there alternatives to 2-Bromo-1,4-dimethylbenzene in synthesis?

In synthesis, alternatives to 2-Bromo-1,4-dimethylbenzene may include other brominated derivatives or similar aromatic compounds. Common substitutes include 2-methyl-1,4-benzenediol or other bromobenzene analogs. These alternatives can provide similar functionalities but may have different reactivity profiles.

What is the market or research trend for 2-Bromo-1,4-dimethylbenzene?

The market for 2-Bromo-1,4-dimethylbenzene (CAS: 553-94-6) is influenced by its use in various industries such as pharmaceuticals, dyes, and organic synthesis. Research trends focus on its potential applications in novel drug development and as a precursor in chemical synthesis. Demand is driven by ongoing innovation in these fields and increasing regulatory scrutiny.

How should waste containing 2-Bromo-1,4-dimethylbenzene be handled?

Waste containing 2-Bromo-1,4-dimethylbenzene (CAS: 553-94-6) should be collected in appropriate containers and disposed of through professional waste disposal services. Incineration is a common method for disposal, but proper environmental protection measures must be taken to prevent contamination. Compliance with local and international regulations is crucial to ensure safe and environmentally friendly disposal.