40077-67-6

Basic information

• Product Name: [2-(3-PHENYL-1,2,4-OXADIAZOL-5-YL)PHENYL]AMINE
• Synonyms: CHEMBRDG-BB 9018559;[2-(3-PHENYL-1,2,4-OXADIAZOL-5-YL)PHENYL]AMINE;TIMTEC-BB SBB014642;UKRORGSYN-BB BBR-015085;2-(3-phenyl-1,2,4-oxadiazol-5-yl)aniline(SALTDATA: FREE)
• CAS NO: 40077-67-6
• Molecular Formula: C₁₄H₁₁N₃O
• Molecular Weight: 237.25664
• Mol File: 40077-67-6.mol
• Article Data: 9

Chemical Properties

• Melting Point: 131-132 °C(Solv: methanol (67-56-1))
• Boiling Point: 438.272 °C at 760 mmHg
• Flash Point: 218.859 °C
• Appearance: /
• Density: 1.239 g/cm³
• Vapor Pressure: 7E-08mmHg at 25°C
• Refractive Index: 1.63
• PKA: 0.37±0.10(Predicted)
• CAS DataBase Reference: [2-(3-PHENYL-1,2,4-OXADIAZOL-5-YL)PHENYL]AMINE(CAS DataBase Reference)
• NIST Chemistry Reference: [2-(3-PHENYL-1,2,4-OXADIAZOL-5-YL)PHENYL]AMINE(40077-67-6)
• EPA Substance Registry System: [2-(3-PHENYL-1,2,4-OXADIAZOL-5-YL)PHENYL]AMINE(40077-67-6)

Safety Data

• Hazardous Substances Data: 40077-67-6(Hazardous Substances Data)

Usage

General Description

[2-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]amine is a chemical compound with the molecular formula C14H11N3O. It is a member of the oxadiazole family of organic compounds, and it consists of a central oxadiazole ring with two phenyl groups attached to it. [2-(3-PHENYL-1,2,4-OXADIAZOL-5-YL)PHENYL]AMINE has potential applications in the field of pharmaceuticals and materials science due to its unique structural and chemical properties. It may be used as a building block in the synthesis of various biologically active compounds, and its specific molecular structure may also confer certain desirable characteristics for use in materials such as polymers and organic electronic devices. Additionally, research may be ongoing to explore its potential use in other areas of chemistry and industry.

InChI:InChI=1/C14H11N3O/c15-12-9-5-4-8-11(12)14-16-13(17-18-14)10-6-2-1-3-7-10/h1-9H,15H2

Upstream product

• 118-48-9 isatoic anhydride 
• 613-92-3 N-hydroxybenzenecarboximidamide 
• 54494-14-3 3-phenyl-5-(2-nitrophenyl)-1,2,4-oxadiazole 
• 40077-66-5 2-amino-N-(N-hydroxy-benzimidoyl)-benzamide 
• 70722-42-8 3-(N-hydroxy-benzimidoyl)-2-methyl-3H-quinazolin-4-one 
• 70722-43-9 2-ethyl-3-(N-hydroxy-benzimidoyl)-3H-quinazolin-4-one 
• 40077-68-7 N-[2-(3-phenyl-[1,2,4]oxadiazol-5-yl)-phenyl]-acetamide 
• 873-67-6 benzonitrile oxide 
• 1885-29-6 anthranilic acid nitrile 
• 134-20-3 2-carbomethoxyaniline 
• 613-92-3 N-hydroxyl-benzamidine 
• 100-47-0 benzonitrile 
• 58589-06-3 N-(2-nitro-benzoyloxy)-benzamidine 
• 932-90-1 Benzaldoxime 

Downstream Products

• 197163-72-7 4-n-butyl-2-phenylquinazoline 
• 93245-19-3 N-Methyl-N-[2-(3-phenyl-[1,2,4]oxadiazol-5-yl)-phenyl]-acetamide 
• 93245-18-2 4-Methyl-N-[2-(3-phenyl-[1,2,4]oxadiazol-5-yl)-phenyl]-benzenesulfonamide 
• 93245-17-1 N-[2-(3-Phenyl-[1,2,4]oxadiazol-5-yl)-phenyl]-benzamide 
• 40077-68-7 N-[2-(3-phenyl-[1,2,4]oxadiazol-5-yl)-phenyl]-acetamide 

Relevant articles and documents

Synthesis and Study of the Structure of Palladium(II) Acyclic Diaminocarbene Complexes Containing a 1,2,4-Oxadiazole Moiety

Abstract: The reaction of anilines containing a 1,2,4-oxadiazole moiety with thebis(xylylisocyanide) Pd(II) complex leads to the formation of acyclicdiaminocarbene complexes. The oxadiazole ring is not involved in the reaction.Composition and structure of the obtained complexes have been confirmed by meansof mass spectrometry, NMR spectroscopy, and single-crystal X-ray diffractionanalysis.

An Efficient Synthesis of 2-Substituted Quinazolin-4(3 H)-ones Catalyzed by Iron(III) Chloride

A simple and highly efficient synthesis of 2-substituted quinazolin-4(3H)-ones by the iron(III) chloride catalyzed reaction of isatoic anhydride with various amidoxime derivatives was developed. Several aryl and alkyl amidoximes were screened to demonstra

The role of the hydrogen bonding in cycloadditions of benzonitrile oxide with cyanophenols

The reactivity of aromatic nitriles in cycloadditions with benzonitrile oxide is remarkably enhanced by the ortho-hydroxy substituent. Semiempirical PM3 calculations are in agreement with a hydrogen bonding effect.