2-(3,5-Dimethylphenyl)quinoline

Basic Information

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CAS Number

1056451-44-5

Molecular Formula

C17H15N

Molecular Weight

233.31 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

375 ºC

Flash Point

162 ºC

SMILES

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CC1=CC(=CC(=C1)C2=NC3=CC=CC=C3C=C2)C

InChI

InChI=1S/C17H15N/c1-12-9-13(2)11-15(10-12)17-8-7-14-5-3-4-6-16(14)18-17/h3-11H,1-2H3

InChIKey

LLXSSVSSSWIZIF-UHFFFAOYSA-N

LogP

4.518640000000003

Topological Polar Surface Area

12.89 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

265

Synonyms & References

English

2-(3,5-Dimethylphenyl)quinoline
AM85465
BCP32322
CHEMBL5172058
SB66533
1056451-44-5
AKOS022174744
MFCD22571707
DTXSID50648815
CS-0085076
LLXSSVSSSWIZIF-UHFFFAOYSA-N
2-(3,5-dimethylphenyl)-quinoline
A847524
BS-49901
DB-354754
SCHEMBL10079213

MDL Number

MFCD22571707

Customs Code

2933499090

FAQ

What are the physical and chemical properties of 2-(3,5-Dimethylphenyl)quinoline (CAS: 1056451-44-5)?

2-(3,5-Dimethylphenyl)quinoline (CAS: 1056451-44-5) is a crystalline solid with a molecular weight of approximately 240.26 g/mol. It has a melting point of around 220-222°C and is slightly soluble in water but soluble in organic solvents like ethanol and acetone. Chemically, it is relatively stable under normal conditions but may react with strong acids and bases. It is not flammable but should be handled with care due to its potential reactivity.

How is 2-(3,5-Dimethylphenyl)quinoline (CAS: 1056451-44-5) typically synthesized?

2-(3,5-Dimethylphenyl)quinoline (CAS: 1056451-44-5) is typically synthesized via a quinoline ring formation using 3,5-dimethylbenzaldehyde and aniline in the presence of a Lewis acid catalyst, such as aluminum trichloride. The reaction usually yields a product with high purity, and the process is selective and efficient with yields up to 90%.

What industries use 2-(3,5-Dimethylphenyl)quinoline (CAS: 1056451-44-5)?

2-(3,5-Dimethylphenyl)quinoline (CAS: 1056451-44-5) is used in various industries, including pharmaceuticals for the synthesis of certain drugs, and in the production of dyes and pigments. It is also used in the development of sensors and materials for their unique electronic properties, making it valuable in semiconductor and polymer industries.

What precautions should be taken when handling 2-(3,5-Dimethylphenyl)quinoline (CAS: 1056451-44-5)?

When handling 2-(3,5-Dimethylphenyl)quinoline (CAS: 1056451-44-5), it is essential to use appropriate personal protective equipment (PPE), including gloves, safety glasses, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to minimize inhalation risks. Spills should be cleaned up immediately using appropriate spill response materials. Always refer to the Material Safety Data Sheet (MSDS) for detailed safety information and emergency procedures.