4,4'-Di(4H-1,2,4-triazol-4-yl)-1,1'-biphenyl | CAS No. 2057437-56-4

4,4'-Di(4H-1,2,4-triazol-4-yl)-1,1'-biphenyl

Basic Information

CAS Number

2057437-56-4

Molecular Formula

C16H12N6

Molecular Weight

288.31 g/mol

AD

Basic Physical Properties

C1=CC(=CC=C1C2=CC=C(C=C2)N3C=NN=C3)N4C=NN=C4

InChI

InChI=1S/C16H12N6/c1-5-15(21-9-17-18-10-21)6-2-13(1)14-3-7-16(8-4-14)22-11-19-20-12-22/h1-12H

InChIKey

BBMVATNCFFPTEB-UHFFFAOYSA-N

LogP

2.5149999999999997

Topological Polar Surface Area

61.42 Ų

Hydrogen Bond Donor/Acceptor

0 / 6

Complexity

303

Synonyms & References

English

  • 4,4'-Di(4H-1,2,4-triazol-4-yl)-1,1'-biphenyl
  • YSWG581
  • 4,4-di(4H-1,2,4-triazol-4-yl)-1,1-biphenyl
  • CS-0110736
  • 2057437-56-4
  • 4-[4'-(4H-1,2,4-triazol-4-yl)-[1,1'-biphenyl]-4-yl]-4H-1,2,4-triazole
  • 4-[4-[4-(1,2,4-triazol-4-yl)phenyl]phenyl]-1,2,4-triazole
  • G66030
  • 4,4-di4H-1,2,4-triazol-4-yl-1,1-biphenyl

MDL Number

MFCD34179891

FAQ

What are the physical and chemical properties of 4,4'-Di(4H-1,2,4-triazol-4-yl)-1,1'-biphenyl (CAS: 2057437-56-4)?

4,4'-Di(4H-1,2,4-triazol-4-yl)-1,1'-biphenyl is a crystalline solid with a molecular weight of approximately 421.33 g/mol. It has low solubility in water but is more soluble in organic solvents like methanol and dichloromethane. The compound exhibits good stability at room temperature and moderate reactivity towards reducing agents and certain nucleophiles.

How is 4,4'-Di(4H-1,2,4-triazol-4-yl)-1,1'-biphenyl (CAS: 2057437-56-4) typically synthesized?

4,4'-Di(4H-1,2,4-triazol-4-yl)-1,1'-biphenyl is typically synthesized through the condensation of 4,4'-dibromobiphenyl with sodium azide in the presence of a suitable base such as potassium carbonate. The reaction is carried out in a solvent like dimethylformamide (DMF) at elevated temperatures. The yield is generally between 70-80%.

What industries use 4,4'-Di(4H-1,2,4-triazol-4-yl)-1,1'-biphenyl (CAS: 2057437-56-4)?

4,4'-Di(4H-1,2,4-triazol-4-yl)-1,1'-biphenyl finds applications in the pharmaceutical industry as a precursor for drug synthesis due to its unique chemical structure. It is also utilized in the semiconductor industry for its electronic properties, in the development of organic light-emitting diodes (OLEDs), and in the manufacturing of certain polymers.

What precautions should be taken when handling 4,4'-Di(4H-1,2,4-triazol-4-yl)-1,1'-biphenyl (CAS: 2057437-56-4)?

When handling 4,4'-Di(4H-1,2,4-triazol-4-yl)-1,1'-biphenyl, it is important to wear appropriate personal protective equipment (PPE) including gloves, goggles, and a lab coat. The substance should be handled in a well-ventilated area or a fume hood to minimize inhalation risks. In case of spill, it should be treated with caution and cleaned up using absorbent material. Always refer to the Safety Data Sheet (SDS) for detailed handling and storage instructions.

Related Compounds

You might also like

Compound Q&A

What is 6-Methyl-7-oxabicyclo[4.1.0]heptan-2-one (CAS: 21889-89-4)?

6-Methyl-7-oxabicyclo[4.1.0]heptan-2-one is a cyclic ketone with a molecular for...

21889-89-46-Methyl-7-oxabicycl...
Compound Q&A

What is 4-[(6-Methyl-2-pyrazinyl)oxy]benzoic acid (CAS: 906353-00-2)?

4-[(6-Methyl-2-pyrazinyl)oxy]benzoic acid is a chemical compound with the CAS nu...

906353-00-24-[(6-Methyl-2-pyraz...
Compound Q&A

What is 2-(2-Pyridinyl)-1,3-propanediol (CAS: 49745-42-8)?

2-(2-Pyridinyl)-1,3-propanediol (CAS: 49745-42-8) is a colorless to slightly yel...

49745-42-82-(2-Pyridinyl)-1,3-...
Compound Q&A

What is 2-(6-Chloro-2-pyridinyl)-2-phenylacetonitrile (CAS: 24783-42-4)?

2-(6-Chloro-2-pyridinyl)-2-phenylacetonitrile is an organic compound with the CA...

24783-42-42-(6-Chloro-2-pyridi...
Compound Q&A

What is 2-Oxopropanamide (CAS: 631-66-3)?

2-Oxopropanamide, also known as 2-aminoacrylic acid, is a chemical compound with...

631-66-32-Oxopropanamide
Compound Q&A

What is 2-Methyl-2-propanyl 4-(5-bromo-6-methyl-2-pyridinyl)-1-piperazinecarboxylate (CAS: 1289040-88-5)?

2-Methyl-2-propanyl 4-(5-bromo-6-methyl-2-pyridinyl)-1-piperazinecarboxylate (CA...

1289040-88-52-Methyl-2-propanyl ...
Compound Q&A

What is NAMPT inhibitor-linker 1 (CAS: 2241019-57-6)?

NAMPT inhibitor-linker 1 (CAS: 2241019-57-6) is a chemical compound designed as ...

2241019-57-6NAMPT inhibitor-link...
Compound Q&A

What is (2-(2,2,2-Trifluoroacetyl)pyridin-4-yl)boronic acid (CAS: 1310404-58-0)?

It is a chemical compound with the structure (2-(2,2,2-Trifluoroacetyl)pyridin-4...

1310404-58-0(2-(2,2,2-Trifluoroa...
Compound Q&A

What is 1-(2-Chlorophenyl)-6-(3,3,3-trifluoro-2-methylpropyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one (CAS: 794568-90-4)?

1-(2-Chlorophenyl)-6-(3,3,3-trifluoro-2-methylpropyl)-1,5-dihydro-4H-pyrazolo[3,...

794568-90-41-(2-Chlorophenyl)-6...
Compound Q&A

What is Vinyl(chloromethyl)dimethoxysilane (CAS: 1314981-48-0)?

Vinyl(chloromethyl)dimethoxysilane is an organosilicon compound with the molecul...

1314981-48-0Vinyl(chloromethyl)d...