Carbonic acid, fluoromethyl methyl ester

Base Information

• Chemical Name: Carbonic acid, fluoromethyl methyl ester
• CAS No.: 207804-61-3
• Molecular Formula: C3H5FO3
• Molecular Weight: 108.06800
• European Community (EC) Number: 606-635-5
• DSSTox Substance ID: DTXSID00469557
• Nikkaji Number: J1.808.176H
• Wikidata: Q82297340
• Mol file: 207804-61-3.mol

Synonyms:Carbonic acid, fluoromethyl methyl ester;207804-61-3;Fluoromethyl Methyl Carbonate;SCHEMBL155971;DTXSID00469557

Chemical Property of Carbonic acid, fluoromethyl methyl ester

Chemical Property:

• Vapor Pressure: 90.1mmHg at 25°C
• Boiling Point: 79.1oC at 760 mmHg
• Flash Point: 2.9oC
• PSA: 35.53000
• Density: 1.157g/cm3
• LogP: 0.69640
• XLogP3: 1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 108.02227218
• Heavy Atom Count: 7
• Complexity: 63.2

Purity/Quality:

99% ^*data from raw suppliers

Fluoromethyl methyl carbonate 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)OCF

Technology Process of Carbonic acid, fluoromethyl methyl ester

There total 4 articles about Carbonic acid, fluoromethyl methyl ester which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 45.0%

carbonic acid dimethyl ester (616-38-6) → difluoromethyl methyl carbonate (70411-01-7) + fluoromethyl methyl carbonate (207804-61-3) + 1,1'-difluorodimethyl carbonate + difluoromethyl fluoromethyl carbonate

Guidance literature:

With fluorine; at 5 ℃; for 24h; Product distribution;

DOI:10.1081/SCC-120030685

Reference yield:

methanol (67-56-1) + formaldehyd (50-00-0,30525-89-4,61233-19-0) + fluoromethyl carbonofluoridate (2838-04-2) → Dimethoxymethane (109-87-5) + fluoromethyl methyl carbonate (207804-61-3)

Guidance literature:

at -10 - 20 ℃; Autoclave;

Reference yield:

chloromethyl methyl carbonate (40510-81-4) → fluoromethyl methyl carbonate (207804-61-3)

Guidance literature:

With potassium fluoride; 18-crown-6 ether; In diethyl ether; for 18h;

upstream raw materials:

carbonic acid dimethyl ester

methanol

formaldehyd

fluoromethyl carbonofluoridate

Refernces

• 1、 Takehara, Masahiro,Watanabe, Susumu,Nanbu, Noritoshi,Ue, Makoto,Sasaki, Yukio. "Synthesis of fluorinated dimethyl carbonates by direct fluorination". . p. 1367 - 1375. Retrieved 2004.
• 2、 -. "PROCESS FOR THE PREPARATION OF FLUOROALKYL (FLUORO)ALKYL CARBONATES AND CARBAMATES". Page/Page column 12. . Retrieved 2011/02/24.