349-60-0

Basic information

• Product Name: 3,5-BIS(TRIFLUOROMETHYL)ANISOLE
• Synonyms: 3,5-BIS(TRIFLUOROMETHYL)ANISOLE;1-Methoxy-3,5-bis(trifluoromethyl)benzene;1,3-Bis(trifluoromethyl)-5-methoxybenzene, 3,5-Bis(trifluoromethyl)phenyl methyl ether
• CAS NO: 349-60-0
• Molecular Formula: C₉H₆F₆O
• Molecular Weight: 244.13
• EINECS: 254-602-5
• Mol File: 349-60-0.mol
• Article Data: 4

Chemical Properties

• Boiling Point: 158-160°C
• Flash Point: 158-160°C
• Appearance: /
• Density: 1.352
• Vapor Pressure: 3.47mmHg at 25°C
• Refractive Index: 1.4075
• Storage Temp.: 2-8°C
• BRN: 2533238
• CAS DataBase Reference: 3,5-BIS(TRIFLUOROMETHYL)ANISOLE(CAS DataBase Reference)
• NIST Chemistry Reference: 3,5-BIS(TRIFLUOROMETHYL)ANISOLE(349-60-0)
• EPA Substance Registry System: 3,5-BIS(TRIFLUOROMETHYL)ANISOLE(349-60-0)

Safety Data

• Hazard Codes: F
• Statements: 10
• Safety Statements: 16
• RIDADR: 3271
• HazardClass: 3
• PackingGroup: III
• Hazardous Substances Data: 349-60-0(Hazardous Substances Data)

Usage

General Description

3,5-Bis(trifluoromethyl)anisole is a chemical compound with the molecular formula C9H6F6O. It is a colorless liquid with a fruity odor, commonly used as a solvent and intermediate in organic synthesis. 3,5-Bis(trifluoromethyl)anisole is known for its high thermal stability and resistance to oxidation, as well as its low reactivity. It is used in the production of pharmaceuticals, agrochemicals, and electronic materials, as well as in the synthesis of various organic compounds. Despite its potential applications, 3,5-Bis(trifluoromethyl)anisole is also known to be toxic to aquatic organisms and has limited information available on its potential health effects in humans.

InChI:InChI=1/C9H6F6O/c1-16-7-3-5(8(10,11)12)2-6(4-7)9(13,14)15/h2-4H,1H3

Upstream product

• 328-72-3 3,5-(bistrifluoromethyl)chlorobenzene 
• 124-41-4 sodium methylate 
• 67-56-1 methanol 
• 328-75-6 1-nitro-3,5-bis(trifluoromethyl)benzene 
• 46331-50-4 5-methoxyisophthalic acid 
• 349-58-6 3,5-bis-(trifluoromethyl)phenol 
• 74-88-4 methyl iodide 
• 328-70-1 3,6-bis(trifluoromethyl)bromobenzene 
• 13036-02-7 Dimethyl 5-hydroxyisophthalate 
• 618-83-7 5-Hydroxyisophthalic acid 
• 20319-44-2 dimethyl 5-methoxyisophthalate 

Downstream Products

• 180134-15-0 2,4-Bis(trifluoromethyl)-6-methoxybenzoic acid 
• 180134-13-8 1-Methoxy-2-methyl-3,5-bis-trifluoromethyl-benzene 
• 180134-14-9 2-Methoxy-4,6-bis-trifluoromethyl-benzaldehyde 
• 180134-16-1 2-Hydroxy-4,6-bis-trifluoromethyl-benzoic acid 
• 1194784-58-1 [(κ3-C6H3-2,6-[CH2P(t-Bu)2]2)Ir(CH3)(3,5-bis(trifluoromethyl)phenoxide)] 
• 1194784-69-4 (C₆H₃(CH₂P(C(CH₃)3)2)2)Ir(C₆H₂(CF₃)2OCH₂) 
• 1427804-33-8 C₃₃H₄₉F₆IrOP₂ 

Relevant articles and documents

Selective Defluoroallylation of Trifluoromethylarenes

We report a fluoride-initiated coupling reaction between trifluoromethylarenes and allylsilanes to access allylated α,α-difluorobenzylic compounds. This method's utility is demonstrated through a 30 mmol scale reaction, a sequential allylation/derivatization protocol and multiple examples of site-selective trifluoromethylarene allylation. Initial mechanistic studies suggest a base-induced single electron transfer pathway is responsible for the high efficiency and selectivity of this novel C-F substitution process.

Method for preparing alkyl ethers and aryl ethers

Method for preparing compounds of the formula (III) by reacting compounds of the formula (II) with a) an alcoholate or b) an alcohol R1-OH and a base in the presence of a Cu-containing catalyst and of a ligand, where X1-5 are independently of one another either carbon or nitrogen, or in each case two adjacent X1R1, with i=1?6, linked by a formal double bond together O, S, NRH or Nrl. The ligands preferably employed are acyclic and/or cyclic oligo- and polyglycols, oligo- and polyamides or oligo- and polyamine glycols of the general formula (IV) k is an integer >0 and n is an integer >1; X and Y are independently of one another O, NH or NR1.