10365-94-3

Basic information

• Product Name: 1,3,5-BENZENETRICARBONITRILE
• Synonyms: TRIMESIC TRINITRILE;1,3,5-BENZENETRICARBONITRILE;benzene-1,3,5-tricarbonitrile;Brn 1942808;Einecs 233-806-8;Tmn;Trimesonitrile
• CAS NO: 10365-94-3
• Molecular Formula: C₉H₃N₃
• Molecular Weight: 153.14
• EINECS: 233-806-8
• Mol File: 10365-94-3.mol

Chemical Properties

• Melting Point: 261-263 °C
• Boiling Point: 256.2°Cat760mmHg
• Flash Point: 113.5°C
• Appearance: /
• Density: 1.27g/cm³
• Vapor Pressure: 0.0156mmHg at 25°C
• Refractive Index: 1.589
• Storage Temp.: Sealed in dry,Room Temperature
• CAS DataBase Reference: 1,3,5-BENZENETRICARBONITRILE(CAS DataBase Reference)
• NIST Chemistry Reference: 1,3,5-BENZENETRICARBONITRILE(10365-94-3)
• EPA Substance Registry System: 1,3,5-BENZENETRICARBONITRILE(10365-94-3)

Safety Data

• RIDADR: UN 3439 6.1/PG III
• RTECS: DC1958000
• HazardClass: 6.1
• PackingGroup: III
• Hazardous Substances Data: 10365-94-3(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Industry:
1,3,5-Benzenetricarbonitrile is used as an intermediate in the synthesis of various pharmaceutical compounds, contributing to the development of new drugs and medications.
Used in Organic Synthesis:
1,3,5-Benzenetricarbonitrile serves as a building block in the synthesis of a wide range of chemical compounds, playing a crucial role in the creation of diverse organic molecules.
Used in Chemical Compound Synthesis:
1,3,5-Benzenetricarbonitrile is employed as a key component in the synthesis of various chemical compounds, enhancing the versatility and applicability of these substances in different industries.
Safety Precautions:
Due to its hazardous potential impacts on health and the environment, handling 1,3,5-Benzenetricarbonitrile requires caution. It is recommended to store it in a cool, ventilated area to minimize risks.

InChI:InChI=1/C9H3N3/c10-4-7-1-8(5-11)3-9(2-7)6-12/h1-3H

Upstream product

• 108-70-3 1,3,5-trichlorobenzene 
• 74-90-8 hydrogen cyanide 
• 1070-71-9 propiolonitrile 
• 74-86-2 acetylene 
• 22445-42-7 3,5-dimethylbenzonitrile 
• 39718-07-5 5-methylbenzene-1,3-dicarbonitrile 
• 108-67-8 1,3,5-trimethyl-benzene 
• 626-39-1 1,3,5-trisbromobenzene 
• 151-50-8 potassium cyanide 
• 35520-41-3 trans-3-dimethylaminoacrylonitrile 
• 554-95-0 benzene-1,3,5-tricarboxylic acid 
• 4422-95-1 1,3,5-benzene tris(carbonyl chloride) 
• 60541-32-4 benzene-1,3,5-tricarboxamide 
• 5666-55-7 (phenylsulfonyl)phosphorimidic trichloride 

Downstream Products

• 127921-63-5 5-Isopropyl-isophthalonitrile 
• 127921-62-4 5-(2-Hydroxy-1,1-dimethyl-propyl)-isophthalonitrile 
• 39718-07-5 5-methylbenzene-1,3-dicarbonitrile 
• 103-29-7 1,1'-(1,2-ethanediyl)bisbenzene 
• 63376-64-7 1,2-bis(3,5-dimethylphenyl)ethane 
• 344299-83-8 1,3,5-tris-(2-amino-2-propyl)benzene 
• 40212-19-9 N,N',N''-trihydroxy-benzene-1,3,5-tricarboximidic acid triamide 
• 177593-51-0 C₆H₃(CN₄Sn(C₄H₉)3)3 
• 1345015-13-5 1,3,5-tris(4,5-diphenylpyridin-2-yl)benzene 

Related news

Normal coordinate analysis and force field of 1,3,5-BENZENETRICARBONITRILE (cas 10365-94-3) (trimesonitrile)07/28/2019

A quadratic force field has been calculated for the molecule 1,3,5-benzenetricarbonitrile (trimesonitrile), starting with a semiempirical MINDO/3 forcedetailed

Relevant articles and documents

The synthesis of poly-nitrile aromatic and oligopyridine ligands via palladium-catalyzed cyanation of aryl halides

Modification of Seller's palladium-catalyzed cyanation procedure for simple aromatic halides leads to a versatile and rapid route to complex multi-nitrile aryl and oligopyridyl ligands that improves on known literature methods. By heating the reagents in the high boiling solvent mesitylene to reflux temperatures at ambient pressure, we have observed the conversion of halogenated precursors to the corresponding nitrile compounds. The resulting compounds can be precipitated from CH2Cl2 solutions of the reaction mixtures and isolated as pure compounds in moderate to high yields. The current approach offers a safer alternative to the pressure tube method, as it does not involve the use of KCN at high pressures. Georg Thieme Verlag Stuttgart.

Instant Photochromism Caused by Radical Formation in Photocatalytic Decarboxylation of Dihydrothiazole Derivative?

A pair of new enantiomeric compounds, (R)/(S)-1,3,5-benzene-triyl-2,2',2”-tris(4,5-dihydrothiazole-4-carboxylic acid) (H3LRRR and H3LSSS) are synthesized in one step synthetic route with high yield. Instant photochromism has been investigated to elaborate the photocatalytic decarboxylation of the dihydrothiazole derivative by electron paramagnetic resonance spectroscopy (EPR), photoluminescence (PL), FT-IR, high resolution mass spectra, X-ray photoelectron spectroscopy and UV-Vis spectroscopic techniques. The results indicate that the photochromic transformation is originated from the formation of the radical during the photocatalytic decarboxylation of the 4,5-dihydrothiazole-4-carboxylic acid units.

Synthesis of poly-nitrile aromatics via palladium-catalyzed cyanation of aryl bromides with potassium hexacyanoferrate(II)

(Chemical Equation Presented) Modification of Beller's palladium-catalyzed cyanation procedure leads to a versatile and rapid route to poly-nitrile aromatics via easily available aryl bromides that improve on known literature methods. All cyanide ions on the iron(II) center of the non-toxic cyanide source [potassium hexacyanoferrate(II)] can be transferred to the aryl halide using palladium(II) acetate and 1,1′-bis(diphenylphosphino)ferrocen (dppf). Copyright Taylor & Francis Group, LLC.

Structural evolution of 2D microporous covalent triazine-based framework toward the study of high-performance supercapacitors

A series of nitrogen-containing micropore-donimated materials, porous triazine-based frameworks (PTFs), are constructed through the structural evolution of a 2D microporous covalent triazine-based framework. The PTFs feature predictable and controllable nitrogen doping and pore structures, which serve as a model-like system to more deeply understand the heteroatom effect and micropore effect in ionic liquid-based supercapacitors. The experimental results reveal that the nitrogen doping can enhance the supercapacitor performance mainly through affecting the relative permittivity of the electrode materials. Although microspores' contribution is not as obvious as the doped nitrogen, the great performances of the micropore-dominated PTF suggest that micropore-dominated materials still have great potential in ionic liquid-based supercapacitors.

Organic molecular material based on benzene ring unit and having long-afterglow effect and preparation method thereof

The invention discloses an organic molecular material based on benzene ring unit and having long-afterglow effect and a preparation method thereof. The structural formula of the organic material is represented as the specification, wherein Y1 to Y4 are respectively one or two of hydrogen atom and cyano group. By introducing the cyano groups in different number to different sites as electron withdrawing groups, the material has high synthetic efficiency and small molecule. When an excitation source is turned off, the material holds durable luminescence for a couple of seconds and has high fluorescent quantum efficiency. The material has an extensive potential application value in the fields such as anti-counterfeiting, bio-imaging, optic-electronic materials and the like.

Corresponding amine nitrile and method of manufacturing thereof

The invention relates to a preparation method of nitrile. Compared with the prior art, the preparation method has the characteristics of obvious reduction of the usage amount of ammonia sources, low environmental pressure, low energy consumption, low production cost, high purity and yields of nitrile products, and the like, and can be used for obtaining nitrile with a more complex structure. The invention also relates to a method for preparing corresponding amine with nitrile.

Corresponding amine nitrile and method of manufacturing thereof

The present invention relates to a nitrile manufacturing method, which has characteristics of significantly-reduced ammonia source consumption, low environmental pressure, low energy consumption, low production cost, high nitrile purity, high nitrile yield and the like compared with the method in the prior art, wherein nitrile having a complicated structure can be obtained through the method. The present invention further relates to a method for producing a corresponding amine from the nitrile.

Immobilization of an Aminobisphosphine–PdII Complex over Graphene Oxide: An Efficient and Reusable Catalyst for Suzuki–Miyaura, Ullmann Coupling and Cyanation Reactions

The grafting of an aminobis(phosphine)–PdII complex (PNP–PdII) [PdCl2{(Ph2P)2N(CH2)3Si(OMe)3}] (2) on graphene oxide (GO) has been carried out by a condensation reaction between methoxysilane groups of 2 and hydroxyl groups of GO. The composite material was characterized by FTIR spectroscopy, solid-state 31P NMR spectroscopy, SEM, TEM, XPS and ICP-AES techniques. All these tools support the clean immobilization of compound 2 on GO. The composite material showed high catalytic activity in Suzuki–Miyaura, Ullmann coupling and cyanation reactions. The heterogeneity of the composite was confirmed by a hot filtration test. The immobilized PNP–PdII shows comparable activity to its homogeneous analogue 2. The recycling ability of the catalyst was examined for five consecutive runs, which showed little or no reduction in its catalytic efficiency.

Corresponding amine nitrile and method of manufacturing thereof (by machine translation)

The invention relates to a method of manufacturing one kind of nitrile, compared with the prior art, has significantly reduced the amount of ammonia, the environmental pressure of the small, low energy consumption, low production cost, nitrile product purity and yield and the like, and can obtain more complex structure of the nitriles. The invention also relates to the corresponding amine by the nitrile manufacture method. (by machine translation)

Pd-Metalated Conjugated Nanoporous Polycarbazoles for Additive-Free Cyanation of Aryl Halides: Boosting Catalytic Efficiency through Spatial Modulation

Transition-metal-catalyzed cyanation of aryl halides is a common route to benzonitriles, which are integral to many industrial procedures. However, traditional homogeneous catalysts for such processes are expensive and suffer poor recyclability, so a heterogeneous analogue is highly desired. A novel spatial modulation approach has been developed to fabricate a heterogeneous Pd-metalated nanoporous polymer, which catalyzes the cyanation of aryl halides without need for ligands. The catalyst displays high activity in the synthesis of benzonitriles, including high product yields, excellent stability and recycling, and broad functional-group tolerance.