Mono-heptafluorobutyl fumarate

Base Information

• Chemical Name: Mono-heptafluorobutyl fumarate
• CAS No.: 952584-86-0
• Molecular Formula: C8H5F7O4
• Molecular Weight: 298.11
• DSSTox Substance ID: DTXSID801022578
• Mol file: 952584-86-0.mol

Synonyms:952584-86-0;MONO-HEPTAFLUOROBUTYL FUMARATE;SCHEMBL4614795;DTXSID801022578;MONO-HEPTAFLUOROBUTYLFUMARATE;MFCD07784261;mono-(2H,2H-Perfluorobut-1-yl) fumarate 97+%;(E)-4-(2,2,3,3,4,4,4-heptafluorobutoxy)-4-oxobut-2-enoic acid

Chemical Property of Mono-heptafluorobutyl fumarate

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 6
• Exact Mass: 298.00760577
• Heavy Atom Count: 19
• Complexity: 385

Purity/Quality:

97% ^*data from raw suppliers

mono-Heptafluorobutyl fumarate 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

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