4-(3,5-Dibromophenyl)-2,6-diphenylpyrimidine

Basic Information

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CAS Number

607740-08-9

Molecular Formula

C22H14Br2N2

Molecular Weight

466.18 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

197.0 to 201.0 deg-C

Density

1.532

SMILES

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BrC1=CC(Br)=CC(C2=NC(C3=CC=CC=C3)=NC(C4=CC=CC=C4)=C2)=C1

InChI

InChI=1S/C22H14Br2N2/c23-18-11-17(12-19(24)13-18)21-14-20(15-7-3-1-4-8-15)25-22(26-21)16-9-5-2-6-10-16/h1-14H

InChIKey

DLXBSWIBLRUGFU-UHFFFAOYSA-N

LogP

7.002600000000005

Topological Polar Surface Area

25.78 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

424

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

4-(3,5-Dibromophenyl)-2,6-diphenylpyrimidine
X4426
Pyrimidine,4-(3,5-dibromophenyl)-2,6-diphenyl-
C22H14Br2N2
VP50187
AX8212407
ST24042873
AM20040836
D4895
A21132
4-(3,5-dibromophenyl)-2,6-diphenyl-pyrimidine
740D089

MDL Number

MFCD16619323

Customs Code

2933599090

FAQ

What are the physical and chemical properties of 4-(3,5-Dibromophenyl)-2,6-diphenylpyrimidine (CAS: 607740-08-9)?

4-(3,5-Dibromophenyl)-2,6-diphenylpyrimidine is a crystalline compound with a molecular weight of approximately 633.4 g/mol. It has low water solubility and moderate solubility in organic solvents. The compound is relatively stable under normal conditions but reacts readily with nucleophiles. It crystallizes in a monoclinic form with a melting point around 260°C. It is not flammable but should be handled in a well-ventilated area to avoid inhalation of its vapors.

How is 4-(3,5-Dibromophenyl)-2,6-diphenylpyrimidine (CAS: 607740-08-9) typically synthesized?

4-(3,5-Dibromophenyl)-2,6-diphenylpyrimidine is typically synthesized through the reaction of 2,6-diphenylpyrimidine with 3,5-dibromobenzoyl chloride in the presence of a base such as triethylamine. The reaction is carried out in an organic solvent like dichloromethane. The yield is usually around 70-80%, and the product is purified by recrystallization from a suitable solvent. The reaction is selective and provides a high degree of purity.

What industries use 4-(3,5-Dibromophenyl)-2,6-diphenylpyrimidine (CAS: 607740-08-9)?

4-(3,5-Dibromophenyl)-2,6-diphenylpyrimidine is used in the pharmaceutical industry for the synthesis of certain drugs. It is also utilized in the development of sensors and in the production of semiconductors due to its electronic properties. The compound has potential applications in polymer chemistry as a dopant or additive to improve material properties.

What precautions should be taken when handling 4-(3,5-Dibromophenyl)-2,6-diphenylpyrimidine (CAS: 607740-08-9)?

When handling 4-(3,5-Dibromophenyl)-2,6-diphenylpyrimidine (CAS: 607740-08-9), it is important to wear appropriate personal protective equipment (PPE) including safety goggles, gloves, and a laboratory coat. The compound should be stored in a cool, dry place away from direct sunlight and heat sources. Handling should be conducted in a well-ventilated area or a fume hood to avoid inhalation of its vapors. In case of spillage, it should be cleaned up immediately using appropriate methods. Always refer to the Safety Data Sheet (SDS) for detailed safety information.