205597-62-2

Basic information

• Product Name: 1,4-Cyclohexadiene,3,3,6-trifluoro-1-methyl-(9CI)
• Synonyms: 1,4-Cyclohexadiene,3,3,6-trifluoro-1-methyl-(9CI)
• CAS NO: 205597-62-2
• Molecular Formula: C7H7F3
• Molecular Weight: 148.1256896
• Product Categories: HALIDE
• Mol File: 205597-62-2.mol
• Article Data: 1

Chemical Properties

• Boiling Point: 89.7±40.0 °C(Predicted)
• Appearance: /
• Density: 1.14±0.1 g/cm3(Predicted)
• CAS DataBase Reference: 1,4-Cyclohexadiene,3,3,6-trifluoro-1-methyl-(9CI)(CAS DataBase Reference)
• NIST Chemistry Reference: 1,4-Cyclohexadiene,3,3,6-trifluoro-1-methyl-(9CI)(205597-62-2)
• EPA Substance Registry System: 1,4-Cyclohexadiene,3,3,6-trifluoro-1-methyl-(9CI)(205597-62-2)

Safety Data

• Hazardous Substances Data: 205597-62-2(Hazardous Substances Data)

Usage

Chemical Class

Cycloalkenes

Substituent

3,3,6-trifluoro-1-methyl

Molecular Weight

150.1 g/mol

Physical State

Colorless liquid

Odor

Distinct

Flammability

Highly flammable

Usage

Organic synthesis and as a reagent in chemical reactions

Safety Precautions

Handle and store in a well-ventilated area and away from sources of ignition due to flammability and potential health hazards.

Upstream product

• 352-70-5 m-Fluorotoluene 

Relevant articles and documents

Competitive fluorination on methyl-group and benzene-ring during the anodic fluorination of fluorotoluenes in Et4NF · mHF

Electrochemical fluorinations of 2-fluorotoluene (2a), 3-fluorotoluene (3a) and 4-fluorotoluene (4a) in neat Et4NF · mHF (Et = C2H5, m = 3.5 or 4.0) were carried out on a platinum anode. The fluorination of 2a, 3a and 4a occurred competitively both on the side-chain (formation of monofluoromethylfluorobenzenes) and on the benzene-ring (formation of methyltrifluoro-1,4-cyclohexadienes). These results are explained by the facility of proton elimination from the methyl groups of the radical cations which have been formed by the anodic one-electron transfer reactions of 2a, 3a and 4a. A cyclic voltammogram of 4a showed three anodic current peaks which correspond to the oxidation of 4a, 1-fluoromethyl-4-fluorobenzene (4b) and 1-difluoromethyl-4-fluorolbenzene (4c). On the other hand, voltammograms of 2a and 3a showed two anodic current peaks and no difluoromethylfluorobenzenes was obtained during the fluorination of 2a and 3a.