(1-bromoethyl)benzene

Basic Information

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CAS Number

585-71-7

Molecular Formula

C8H9Br

Molecular Weight

185.06 g/mol

Chemical Classification

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

-65°C

Boiling Point

200°C

Solubility

Soluble in alcohol, ether, and benzene.

Refractive Index

n20/D 1.56(lit.)

SMILES

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CC(C1=CC=CC=C1)Br

InChI

InChI=1S/C8H9Br/c1-7(9)8-5-3-2-4-6-8/h2-7H,1H3

InChIKey

CRRUGYDDEMGVDY-UHFFFAOYSA-N

LogP

3.142500000000002

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

74.6

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

Moisture Sensitive

Synonyms & References

English

38661-81-3
.alpha.-Phenethyl bromide
(1-BROMOETHYL)BENZENE [HSDB]
alpha-Phenylethyl bromide
SCHEMBL1551
(1-Bromoethyl)-benzene
methyl benzyl bromide
NSC-8052
(l-bromoethyl)benzene
585-71-7
J-802000
Benzene, (1-bromoethyl)-
CCRIS 1779
DTXSID70883448
Q27280714
AMY25716
FT-0622117
1-Phenylethyl bromide
Benzene-d5, (1-bromoethyl-1,2,2,2-d4)-
(1-Bromoethyl)benzene, 97%
NS00043088
EN300-21177
1-bromoethylbenzene
HSDB 2736
alpha-Phenethyl bromide
(alpha-Bromoethyl)benzene
alpha-Methylbenzyl bromide
(1-bromo-ethyl)-benzene
SY048730
SY315910
B0592

MDL Number

MFCD00000139

FAQ

What regulatory guidelines apply to (1-bromoethyl)benzene (CAS: 585-71-7)?

The regulatory guidelines for (1-bromoethyl)benzene (CAS: 585-71-7) include the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), which classifies it as a hazardous chemical due to its flammable and toxic properties. In Europe, it is regulated under REACH, and in the US, it is subject to FDA and EPA requirements for safety and environmental protection.

Are there alternatives to (1-bromoethyl)benzene in synthesis?

Yes, alternatives to (1-bromoethyl)benzene in synthesis include other brominated benzenes, such as 2-bromophenylacetone, which can serve similar roles in certain reactions. Other common substitutes include halogenated compounds like chlorobenzene or fluorenone, depending on the specific application and reactivity requirements.

What is the market or research trend for (1-bromoethyl)benzene (CAS: 585-71-7)?

The market for (1-bromoethyl)benzene (CAS: 585-71-7) is driven by its use in the synthesis of pharmaceuticals and dyes. Research trends are focusing on developing more sustainable and environmentally friendly alternatives, as well as exploring its potential in new applications such as organocatalysis and functional materials.

How should waste containing (1-bromoethyl)benzene (CAS: 585-71-7) be handled?

Waste containing (1-bromoethyl)benzene (CAS: 585-71-7) should be collected in appropriate containers and stored in a well-ventilated area away from sources of ignition. It should be disposed of through incineration at a professional waste disposal facility, or by other methods approved under local environmental regulations to minimize environmental impact and ensure safety.