4,6-Diphenyl-1,3,5-triazin-2(1H)-one

Basic Information

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CAS Number

1917-44-8

Molecular Formula

C15H11N3O

Molecular Weight

249.27 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

294-295 ºC

Boiling Point

391.1°Cat760mmHg

Flash Point

190.4°C

Refractive Index

1.662

SMILES

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C1=CC=C(C=C1)C2=NC(=NC(=O)N2)C3=CC=CC=C3

InChI

InChI=1S/C15H11N3O/c19-15-17-13(11-7-3-1-4-8-11)16-14(18-15)12-9-5-2-6-10-12/h1-10H,(H,16,17,18,19)

InChIKey

KODLDJGSBFMSDG-UHFFFAOYSA-N

LogP

2.911200000000001

Topological Polar Surface Area

58.900000000000006 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

402

Synonyms & References

English

s-Triazin-2(1H)-one,6-diphenyl-
1,3,5-Triazin-2(1H)-one, 4,6-diphenyl-
RF 01839
AKOS016006488
NSC-288740
SMR000456708
2,4-Diphenyl-6-hydroxy-1,3,5-triazine
BAA91744
MFCD00234864
AKOS024258536
AS-63616
2,6-Di(phenyl)-1H-1,3,5-triazin-4-one
SCHEMBL8038468
CHEMBL1570430
2,6-diphenyl-1H-1,3,5-triazin-4-one
DTXSID60274563
AC-907/25005275
EC 606-251-8
Maybridge1_006026
4,6-diphenyl-1,3,5-triazin-2(1H)-one
NSC288740
CCG-1869
4,6-diphenyl-[1,3,5]triazin-2-ol
4,6-diphenyl-1,2-dihydro-1,3,5-triazin-2-one
MLS000850691
NCGC00246688-01
FT-0720776
D5548
2-hydroxy-4,6-diphenyl-1,3,5-triazine
NSC 288740
A813516

MDL Number

MFCD06803262

FAQ

What are the physical and chemical properties of 4,6-Diphenyl-1,3,5-triazin-2(1H)-one (CAS: 1917-44-8)?

4,6-Diphenyl-1,3,5-triazin-2(1H)-one is a crystalline solid with a molecular weight of approximately 280.26 g/mol. It has limited water solubility and good solubility in organic solvents such as dimethyl sulfoxide (DMSO) and dimethylformamide (DMF). Chemically, it is characterized by its high stability and moderate reactivity, particularly in nucleophilic substitution reactions.

How is 4,6-Diphenyl-1,3,5-triazin-2(1H)-one (CAS: 1917-44-8) typically synthesized?

4,6-Diphenyl-1,3,5-triazin-2(1H)-one is commonly synthesized via the Stetter reaction, which involves the condensation of 2,4-diamino-6-phenyl-1,3,5-triazine with phenylacetonitrile. This method provides good yields and high selectivity, often without the need for additional catalysts.

What industries use 4,6-Diphenyl-1,3,5-triazin-2(1H)-one (CAS: 1917-44-8)?

4,6-Diphenyl-1,3,5-triazin-2(1H)-one is primarily used in the pharmaceutical industry for its role in drug synthesis, particularly in the development of antiviral and antifungal agents. It also finds applications in the polymer industry as a stabilizer and in the electronics industry for its use in sensors and semiconductor materials.

What precautions should be taken when handling 4,6-Diphenyl-1,3,5-triazin-2(1H)-one (CAS: 1917-44-8)?

When handling 4,6-Diphenyl-1,3,5-triazin-2(1H)-one, it is important to wear appropriate personal protective equipment (PPE) including gloves, safety goggles, and a laboratory coat. Work should be conducted in a well-ventilated hood to minimize exposure. In case of spillage, immediately clean up using appropriate absorbent materials and ensure proper disposal. Always consult the Safety Data Sheet (SDS) for detailed emergency procedures.