4'-(Tribromomethyl)-[1,1'-biphenyl]-2-carbonitrile

Basic Information

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CAS Number

876063-64-8

Molecular Formula

C14H8Br3N

Molecular Weight

429.93 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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C1=CC=C(C(=C1)C#N)C2=CC=C(C=C2)C(Br)(Br)Br

InChI

1S/C14H8Br3N/c15-14(16,17)12-7-5-10(6-8-12)13-4-2-1-3-11(13)9-18/h1-8H

InChIKey

ZMOBZMJHPMWMLQ-UHFFFAOYSA-N

LogP

0.16199999999999998

Topological Polar Surface Area

35.0 Å²

Hydrogen Bond Donor/Acceptor

3 / 1

Complexity

320

Synonyms & References

English

4'-(Tribromomethyl)-[1,1'-biphenyl]-2-carbonitrile
4′-(Tribromomethyl)[1,1′-biphenyl]-2-carbonitrile (ACI)
BS-47938
E75571
2-[4-(Tribromomethyl)phenyl]benzonitrile
876063-64-8
SCHEMBL6951936
DB-262678

FAQ

What are the physical and chemical properties of 4'-(Tribromomethyl)-[1,1'-biphenyl]-2-carbonitrile (CAS: 876063-64-8)?

4'-(Tribromomethyl)-[1,1'-biphenyl]-2-carbonitrile is a crystalline solid with a molecular weight of approximately 504.18 g/mol. It has low water solubility and moderate solubility in organic solvents. The compound is relatively stable under normal conditions but may react with reducing agents. It shows moderate reactivity towards nucleophiles.

How is 4'-(Tribromomethyl)-[1,1'-biphenyl]-2-carbonitrile (CAS: 876063-64-8) typically synthesized?

4'-(Tribromomethyl)-[1,1'-biphenyl]-2-carbonitrile can be synthesized via a multistep process involving bromination of [1,1'-biphenyl]-2-carbonitrile followed by coupling reactions. The synthesis typically requires the use of appropriate catalysts and reagents, with high selectivity and yield achievable under optimized conditions.

What industries use 4'-(Tribromomethyl)-[1,1'-biphenyl]-2-carbonitrile (CAS: 876063-64-8)?

4'-(Tribromomethyl)-[1,1'-biphenyl]-2-carbonitrile is used in the pharmaceutical and sensor industries due to its unique chemical structure. It can be utilized in the development of certain drug molecules and as a sensing component in various analytical devices.

What precautions should be taken when handling 4'-(Tribromomethyl)-[1,1'-biphenyl]-2-carbonitrile (CAS: 876063-64-8)?

When handling 4'-(Tribromomethyl)-[1,1'-biphenyl]-2-carbonitrile, it is essential to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated fume hood. In case of a spill, immediately clean up the area using appropriate absorbent materials and consult the Safety Data Sheet (SDS) for further instructions.

Related Compounds

Ethyl 3-amino-5-methyl-1H-pyrrole-2-carboxylate structure

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Compound Q&A

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4'-(Tribromomethyl)-[1,1'-biphenyl]-2-carbonitrile | CAS No. 876063-64-8

Basic Information

CAS Number

Molecular Formula

Molecular Weight

Chemical Classification

Basic Physical Properties

Chemical Properties

SMILES

InChI

InChIKey

LogP

Topological Polar Surface Area

Hydrogen Bond Donor/Acceptor

Complexity

Synonyms & References

English

FAQ

What are the physical and chemical properties of 4'-(Tribromomethyl)-[1,1'-biphenyl]-2-carbonitrile (CAS: 876063-64-8)?

How is 4'-(Tribromomethyl)-[1,1'-biphenyl]-2-carbonitrile (CAS: 876063-64-8) typically synthesized?

What industries use 4'-(Tribromomethyl)-[1,1'-biphenyl]-2-carbonitrile (CAS: 876063-64-8)?

What precautions should be taken when handling 4'-(Tribromomethyl)-[1,1'-biphenyl]-2-carbonitrile (CAS: 876063-64-8)?

Related Compounds

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Supplier Information

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