Bis(perfluorooctyl)itaconate

Base Information

• Chemical Name: Bis(perfluorooctyl)itaconate
• CAS No.: 243977-25-5
• Molecular Formula: C21H4F34O4
• Molecular Weight: 966.2
• DSSTox Substance ID: DTXSID90896116
• Wikidata: Q82872355
• Mol file: 243977-25-5.mol

Synonyms:Bis(perfluorooctyl)itaconate;243977-25-5;Bis(heptadecafluorooctyl) 2-methylidenebutanedioate;Bis(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl) 2-methylidenebutanedioate;Butanedioic acid, 2-methylene-, 1,4-bis(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl) ester;SCHEMBL942320;DTXSID90896116;FJDNRGZXGFXROS-UHFFFAOYSA-N;bis(perfluorooctyl) 2-methylenesuccinate;2,3-DIMETHYL-1,2,3,4-TETRAHYDRO-QUINOXALINE-5-CARBOXYLICACID

Chemical Property of Bis(perfluorooctyl)itaconate

Chemical Property:

• Boiling Point: 367.8±42.0 °C(Predicted)
• Density: 1.716±0.06 g/cm3(Predicted)
• XLogP3: 12.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 38
• Rotatable Bond Count: 19
• Exact Mass: 965.9566661
• Heavy Atom Count: 59
• Complexity: 1590

Purity/Quality:

98%min ^*data from raw suppliers

Bis(perfluorooctyl)itaconate 97% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

Useful:

• Canonical SMILES: C=C(CC(=O)OC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)OC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F