1885-35-4

Basic information

• Product Name: 3,4,5-Trimethoxybenzonitrile
• Synonyms: 3,4,5-Trimethoxybenzonitrile, 97+%;Benzonitrile, 3,4,5-trimethoxy-;3,4,5-TRIMETHOXYBENZONITRILE 98+%;3,4,5-Trimethoxybenz;5-TriMethoxybenzonitrile;3,4,5-TriMethoxybenzonitrile;3,4,5-Trimethoxybenzenecarbonitrile;3,4,5-trimethoxy-benzonitril
• CAS NO: 1885-35-4
• Molecular Formula: C₁₀H₁₁NO₃
• Molecular Weight: 193.2
• EINECS: 217-550-4
• Product Categories: Aromatic Nitriles;C10 to C27;Cyanides/Nitriles;Nitrogen Compounds
• Mol File: 1885-35-4.mol
• Article Data: 92

Chemical Properties

• Melting Point: 91-94 °C(lit.)
• Boiling Point: 180-185 °C10 mm Hg(lit.)
• Flash Point: 180-185°C/10mm
• Appearance: White to beige powder
• Density: 1.2307 (rough estimate)
• Vapor Pressure: 0.000174mmHg at 25°C
• Refractive Index: 1.5300 (estimate)
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility: soluble in Methanol
• BRN: 979686
• CAS DataBase Reference: 3,4,5-Trimethoxybenzonitrile(CAS DataBase Reference)
• NIST Chemistry Reference: 3,4,5-Trimethoxybenzonitrile(1885-35-4)
• EPA Substance Registry System: 3,4,5-Trimethoxybenzonitrile(1885-35-4)

Safety Data

• Hazard Codes: Xn,Xi
• Statements: 20/21/22-36/37/38-21/22
• Safety Statements: 26-37/39-36/37
• RIDADR: 3276
• WGK Germany: 3
• RTECS: DI4965000
• HazardClass: 6.1
• PackingGroup: III
• Hazardous Substances Data: 1885-35-4(Hazardous Substances Data)

Usage

Chemical Properties

WHITE TO BEIGE POWDER

InChI:InChI=1/C10H11NO3/c1-12-8-4-7(6-11)5-9(13-2)10(8)14-3/h4-5H,1-3H3

Upstream product

• 3086-62-2 3,4,5-trimethoxybenzamide 
• 108-24-7 acetic anhydride 
• 3840-31-1 (3,4,5-trimethoxyphenyl)methanol 
• 7605-28-9 2-(phenylsulfonyl)acetonitrile 
• 118-41-2 Eudesmic acid 
• 75921-68-5 1,2,3-trimethoxy-5-(methoxymethyl)benzene 
• 86-81-7 3,4,5-trimethoxy-benzaldehyde 
• 13904-95-5 S,S-dimethylsulfodiimide 
• 592-87-0 lead(II) thiocyanate 
• 557-21-1 zinc(II) cyanide 
• 18168-86-0 methyl(3,4,5-trimethoxyphenyl)sulfide 
• 25245-29-8 5-iodo-1,2,3-trimethoxybenzene 
• 119072-55-8 tert-butylisonitrile 
• 613-90-1 benzoyl cyanide 

Downstream Products

• 91759-55-6 5-(3,4,5-trimethoxyphenyl)-1H-tetrazole 
• 5650-43-1 1-(4-hydroxy-3,5-dimethoxyphenyl)propan-1-one 
• 1136-86-3 methyl (3,4,5-trimethoxyphenyl) ketone 
• 107190-62-5 3,4,5-trimethoxybenzamidrazone 
• 107190-53-4 N¹-(2,6-dichlorobenzyliden)-3,4,5-trimethoxybenzamidrazone 
• 107190-55-6 C₁₇H₁₈ClN₃O₃ 
• 107190-54-5 C₁₇H₁₈ClN₃O₃ 
• 107190-56-7 C₁₉H₂₃N₃O₅ 
• 107190-57-8 C₂₀H₂₅N₃O₆ 
• 107190-58-9 C₁₇H₂₀Cl₂N₆O₃ 
• 62616-09-5 2-Phenyl-4-(3',4',5'-trimethoxybenzylidene)oxazolone 
• 38897-26-6 3,4,5-trihydroxybenzonitrile 
• 1134188-82-1 bis-1,1'-(5,6,7,8-tetrahydro-3-(3,4,5-trimethoxyphenyl)-isoquinoline) 
• 1201847-81-5 5,6,7,8-tetrahydro-1-(5,6,7,8-tetrahydro-3-(3,4,5-trimethoxyphenyl)isoquinolin-1-yl)-3-methylisoquinoline 

Relevant articles and documents

Erratum: Copper-mediated cyanation of indoles and electron-rich arenes using DMF as a single surrogate (Org. Biomol. Chem. (2015) 13 (8322-8329))

Correction for 'Copper-mediated cyanation of indoles and electron-rich arenes using DMF as a single surrogate' by Lianpeng Zhang et al., Org. Biomol. Chem., 2015, 13, 8322-8329.

Zinc chloride-catalyzed expeditious route to nitriles

Zinc chloride has been found to be an excellent catalyst for a one-pot synthesis of nitriles from araldehydes and hydroxylammonium chloride under solvent-free conditions. The features of the present method are short reaction time, easy workup procedure, and good yields of the nitriles.

Nickel-Catalyzed Cyanation of Aryl Thioethers

A nickel-catalyzed cyanation of aryl thioethers using Zn(CN)2 as a cyanide source has been developed to access functionalized aryl nitriles. The ligand dcype (1,2-bis(dicyclohexylphosphino)ethane) in combination with the base KOAc (potassium acetate) is essential for achieving this transformation efficiently. This reaction involves both a C-S bond activation and a C-C bond formation. The scalability, low catalyst and reagents loadings, and high functional group tolerance have enabled both late-stage derivatization and polymer recycling, demonstrating the reaction's utility across organic chemistry.

Method for converting aromatic aldehyde into aromatic nitrile by using sulfur powder promoted inorganic ammonium as nitrogen source (by machine translation)

The invention discloses a method for converting aromatic aldehyde into aromatic nitrile. The method is conversion of high yield of aromatic aldehyde one-pot reaction of sulfur powder promoted inorganic ammonium as a nitrogen source into aromatic nitrile. The method has the advantages of no need of metal participation, no need of strong oxide, compatibility of reaction to air, easiness in amplification to a gram scale and the like, and overcomes the problems of harsh reaction conditions, complex operation, low functional group compatibility and the like in the prior art. (by machine translation)