4-Bromo-1,1':3',1''-terphenyl

Basic Information

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CAS Number

54590-37-3

Molecular Formula

C18H13Br

Molecular Weight

309.21 g/mol

Chemical Classification

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

90-95 °C

Boiling Point

421.5±14.0 °C at 760 mmHg

Density

1.309±0.06 g/cm3 (20 ºC 760 Torr),

Flash Point

205.0±14.5 °C

Solubility

Insuluble (4.9E-5 g/L) (25 ºC),

Vapor Pressure

0.0±1.0 mmHg at 25°C

SMILES

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Brc1ccc(cc1)c1cccc(c1)c1ccccc1

InChI

InChI=1S/C18H13Br/c19-18-11-9-15(10-12-18)17-8-4-7-16(13-17)14-5-2-1-3-6-14/h1-13H

InChIKey

XWHCOAVJEOENNM-UHFFFAOYSA-N

LogP

5.783100000000004

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

4-Bromo-m-terphenyl
1-bromo-4-(3-phenylphenyl)benzene
4-Bromo-1,1':3',1''-terphenyl

MDL Number

MFCD20486761

FAQ

What is 4-Bromo-1,1':3',1''-terphenyl (CAS: 54590-37-3)?

4-Bromo-1,1':3',1''-terphenyl (CAS: 54590-37-3) is a complex aromatic organic compound. It consists of three phenyl rings connected through the 1,1',3',1''-positions. This compound has a high melting point and is mainly used in research and industrial applications for its unique molecular structure.

What are the main uses of 4-Bromo-1,1':3',1''-terphenyl (CAS: 54590-37-3)?

4-Bromo-1,1':3',1''-terphenyl (CAS: 54590-37-3) is primarily used in research and industrial applications, particularly in organic synthesis, as a monomer for polymers, and in the development of functional materials. It is also used in pharmaceutical research for studying molecular interactions and as a precursor in the synthesis of other compounds.

Is 4-Bromo-1,1':3',1''-terphenyl (CAS: 54590-37-3) safe?

4-Bromo-1,1':3',1''-terphenyl (CAS: 54590-37-3) requires proper handling due to its brominated nature. It can be hazardous if not handled correctly. Users should wear appropriate personal protective equipment, including gloves, goggles, and lab coats. It should be stored in a cool, dry place away from direct sunlight and flammable materials. Proper disposal methods should also be followed.

How should 4-Bromo-1,1':3',1''-terphenyl (CAS: 54590-37-3) be stored?

4-Bromo-1,1':3',1''-terphenyl (CAS: 54590-37-3) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent exposure to moisture and air. Ideal storage conditions include a temperature range of 10-25°C and a relative humidity below 50%. Avoid storing it near flammable materials to reduce fire risks.