2,2,3,3,4,4,4-Heptafluorobutyl acrylate

Base Information

• Chemical Name: 2,2,3,3,4,4,4-Heptafluorobutyl acrylate
• CAS No.: 424-64-6
• Molecular Formula: C7H5 F7 O2
• Molecular Weight: 254.104
• Hs Code.: 29161210
• European Community (EC) Number: 207-036-8
• DSSTox Substance ID: DTXSID8059978
• Nikkaji Number: J196.101B
• Wikidata: Q72481254
• Mol file: 424-64-6.mol

Synonyms:424-64-6;1H,1H-Heptafluorobutyl acrylate;2,2,3,3,4,4,4-Heptafluorobutyl acrylate;Heptafluorobutyl acrylate;2,2,3,3,4,4,4-heptafluorobutyl prop-2-enoate;1h,1h-heptafluorobutylacrylate;C7H5F7O2;2-Propenoic acid, 2,2,3,3,4,4,4-heptafluorobutyl ester;1h,1h-perfluorobutyl acrylate;EINECS 207-036-8;SCHEMBL36471;DTXSID8059978;1H,1H-Heptafluorobut-1-yl acrylat;1H,1H-Heptafluorobut-1-yl acrylate;MFCD00039252;AKOS007930439;BS-22710;CS-0121321;FT-0609062;2,2,3,3,4,4,4-Heptafluorobutyl=propenoate;D83497;2,2,3,3,4,4,4-Heptafluorobutyl acrylate, 97%

Chemical Property of 2,2,3,3,4,4,4-Heptafluorobutyl acrylate

Chemical Property:

• Appearance/Colour: colorless to light yellow Clear liquid
• Vapor Pressure: 12.7mmHg at 25°C
• Refractive Index: n20/D 1.331(lit.)
• Boiling Point: 124.6 °C at 760 mmHg
• Flash Point: 29.3 °C
• Density: 1.404 g/cm³
• Storage Temp.: Flammables area
• Sensitive.: Lachrymatory
• Water Solubility.: Not miscible in water.
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 5
• Exact Mass: 254.01777653
• Heavy Atom Count: 16
• Complexity: 281

Purity/Quality:

98%,99%, ^*data from raw suppliers

1H,1H-Heptafluorobutyl acrylate 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xn,Xi
• Statements: 10-20/21/22-36/37
• Safety Statements: 16-26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C=CC(=O)OCC(C(C(F)(F)F)(F)F)(F)F
• Uses: 2,2,3,3,4,4,4-Heptafluorobutyl acrylate is a useful fluorinated acrylate for proteomics research. It is also used as pharmaceutical intermediate.

Technology Process of 2,2,3,3,4,4,4-Heptafluorobutyl acrylate

There total 2 articles about 2,2,3,3,4,4,4-Heptafluorobutyl acrylate 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:

acrylic acid (79-10-7) + trifluoroacetic anhydride (407-25-0) → 2,2,3,3,4,4,4-heptafluorobutyl acrylate (424-64-6)

Guidance literature:

anschliessend mit 1H,1H-Heptaflour-butan-1-ol;

DOI:10.1002/pol.1955.120158018 DOI:10.1021/ja01100a502

Reference yield:

2,2,3,3,4,4,4-heptafluorobutanol (375-01-9) + acryloyl chloride (814-68-6,25189-84-8) → 2,2,3,3,4,4,4-heptafluorobutyl acrylate (424-64-6)

Guidance literature:

With barium(II) chloride;

Reference yield: 53.0%

2,2,3,3,4,4,4-heptafluorobutyl acrylate (424-64-6) + 4-nitrobenzaldehdye (555-16-8) → (2S,6S)-2,6-di(4-nitrophenyl)-5-methylene-1,3-dioxan-4-one + (2R,6R)-2,6-di(4-nitrophenyl)-5-methylene-1,3-dioxan-4-one + 1,1,1,2,2,3,3-heptafluorobutyl 3-hydroxy-2-methylene-3-(4-nitrophenyl)propanoate

Guidance literature:

With (3R,8R,9S)-10,11-dihydro-3,9-epoxy-6'-hydroxy-cinchonane; In N,N-dimethyl-formamide; at -55 ℃; for 72h;

DOI:10.1016/j.tet.2005.09.072

upstream raw materials:

acrylic acid

trifluoroacetic anhydride

2,2,3,3,4,4,4-heptafluorobutanol

acryloyl chloride