[(4-Bromobutoxy)methyl]benzene

Basic Information

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CAS Number

60789-54-0

Molecular Formula

C11H15BrO

Molecular Weight

243.14 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

Colourless

Melting Point

No data available

Boiling Point

115 °C / 0.4mmHg

Density

1.28

Flash Point

113 °C

Solubility

Chloroform (Slightly), Methanol (Slightly)

Refractive Index

n20/D 1.529(lit.)

SMILES

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BrCCCCOCc1ccccc1

InChI

InChI=1S/C11H15BrO/c12-8-4-5-9-13-10-11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2

InChIKey

ZQRVGYAMRJVUAK-UHFFFAOYSA-N

LogP

3.378300000000002

Topological Polar Surface Area

9.23 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

111

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

Synonyms & References

English

4-Benzyloxy-1-bromobutane
4-Benzyloxybutyl Bromide (4-Bromobutoxymethyl)benzene
Benzene, [(4-broMobutoxy)Methyl]-
4-Bromobutyl phenylmethyl ether
1-((4-bromobutoxy)methyl)benzene
4-BENZYLOXYBUTYL BROMIDE
(4-BROMOBUTOXYMETHYL)BENZENE
BENZYL 4-BROMOBUTYL ETHER
((4-Bromobutoxy)methyl)benzene
4-bromobutoxymethylbenzene
Benzyl 4-bromobutyl ether
4-Benzyloxybutyl Bromide
(4-Bromobutoxymethyl)benzene
[(4-Bromobutoxy)methyl]benzene
BENZYL4-BROMOBUTYLETHER
Benzene, [(4-bromobutoxy)methyl]-
benzoxybutyl bromide
4-Bromobutylbenzyl ether
4-benzyloxy-1-bromo-butane
1-Bromo-4-benzyloxy-butane
(4-bromobutoxymethyl)-benzene
4-bromobutyl phenylmethyl ether
ZQRVGYAMRJVUAK

MDL Number

MFCD00155128

Customs Code

29093090

FAQ

What regulatory guidelines apply to [(4-Bromobutoxy)methyl]benzene (CAS: 60789-54-0)?

The compound [(4-Bromobutoxy)methyl]benzene (CAS: 60789-54-0) falls under the scope of the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) and is classified as a hazardous substance. It must comply with REACH regulations in the European Union, and with FDA and EPA guidelines in the United States. Specific safety data sheets (SDS) should be prepared for workplace handling and storage, and MSDS should be available for shipping and transportation purposes.

Are there alternatives to [(4-Bromobutoxy)methyl]benzene (CAS: 60789-54-0) in synthesis?

There are alternative reagents that can be used in similar synthetic pathways, such as [(4-Iodoethoxy)methyl]benzene and [(4-Chlorobutoxy)methyl]benzene. These compounds can serve as useful substitutes depending on the specific requirements of the synthesis and the desired product properties. Alternative reagents may offer different reactivity profiles and may be preferred based on cost, availability, and environmental considerations.

What is the market or research trend for [(4-Bromobutoxy)methyl]benzene (CAS: 60789-54-0)?

The market for [(4-Bromobutoxy)methyl]benzene (CAS: 60789-54-0) is primarily driven by its use in pharmaceuticals, specifically in the development of prodrugs and intermediates. Research trends indicate an increasing focus on green chemistry and sustainable processes. The compound is also being explored for potential applications in materials science and as a functional monomer in polymer chemistry. Market demand is expected to grow as new applications are discovered.

How should waste containing [(4-Bromobutoxy)methyl]benzene (CAS: 60789-54-0) be handled?

Waste containing [(4-Bromobutoxy)methyl]benzene (CAS: 60789-54-0) should be collected in appropriate, labeled containers and disposed of according to local regulations. Incineration is a common method for waste disposal, but professional waste disposal services are recommended to ensure compliance with environmental protection standards. Environmental precautions include proper ventilation and the use of personal protective equipment (PPE) to prevent exposure and ensure safe handling of the waste material.