1-(Trifluoromethyl)vinyl acetate

Base Information

• Chemical Name: 1-(Trifluoromethyl)vinyl acetate
• CAS No.: 2247-91-8
• Molecular Formula: C5H5F3O2
• Molecular Weight: 154.089
• Hs Code.: 2915390090
• European Community (EC) Number: 218-838-2
• DSSTox Substance ID: DTXSID80883818
• Nikkaji Number: J213.141B
• Wikidata: Q82862631
• Mol file: 2247-91-8.mol

Synonyms:1-(Trifluoromethyl)vinyl acetate;2247-91-8;3,3,3-trifluoroprop-1-en-2-yl acetate;Trifluoroacetone enol acetate;1-(Trifluoromethyl)ethenyl acetate;1-Propen-2-ol, 3,3,3-trifluoro-, acetate;Trifluoroacetone enolacetate;alpha-Trifluoromethylvinyl acetate;1-Propen-2-ol, 3,3,3-trifluoro-, 2-acetate;EINECS 218-838-2;1-(TRIFLUOROMETHYL)VINYLACETATE;25212-05-9;SCHEMBL1322720;DTXSID80883818;MFCD00040844;AKOS006220476;AS-47963;FT-0622076;1-Propen-2-ol,3,3,3-trifluoro-,2-acetate;F17131

Chemical Property of 1-(Trifluoromethyl)vinyl acetate

Chemical Property:

• Appearance/Colour: clear colorless to slightly yellow liquid
• Refractive Index: 1.341-1.346
• Boiling Point: 113.9 °C at 760 mmHg
• Flash Point: 24 °C
• PSA: 26.30000
• Density: 1.224g/cm³
• LogP: 1.62550
• Storage Temp.: 0-6°C
• Sensitive.: Moisture Sensitive
• Water Solubility.: Not miscible or difficult to mix in water.
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 154.02416388
• Heavy Atom Count: 10
• Complexity: 159

Purity/Quality:

99% ^*data from raw suppliers

1-(Trifluoromethyl)vinyl acetate 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn; F
• Hazard Codes: Xn-F,F,Xn
• Statements: 36/37-20/21/22-11
• Safety Statements: 36/37/39-26-16-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OC(=C)C(F)(F)F
• Uses: 1-(Trifluoromethyl)vinyl acetate is used as a chemical, organic Intermediates.

Technology Process of 1-(Trifluoromethyl)vinyl acetate

There total 1 articles about 1-(Trifluoromethyl)vinyl acetate 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:

→ 1,1,1-Trifluoro-2-(acetyloxy)-2-propene (2247-91-8)

Guidance literature:

/BRN= 207532/ mit Bu3N ;

Reference yield: 93.0%

1,1,1-Trifluoro-2-(acetyloxy)-2-propene (2247-91-8) + phenol (108-95-2,27073-41-2) → Phenyl acetate (122-79-2,34474-31-2)

Guidance literature:

With 1,4-diaza-bicyclo[2.2.2]octane; In neat (no solvent); at 60 - 140 ℃; for 0.183333h; Microwave irradiation;

DOI:10.1039/c5nj01436k

Downstream raw materials:

Phenyl acetate