Monomers

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

Identifiers

IUPAC name
2,2,3,3,4,4,4-heptafluorobutyl prop-2-enoate
InchI
InChI=1S/C7H5F7O2/c1-2-4(15)16-3-5(8,9)6(10,11)7(12,13)14/h2H,1,3H2
InchI Key
PLXOUIVCSUBZIX-UHFFFAOYSA-N
SMILES
C=CC(=O)OCC(C(C(F)(F)F)(F)F)(F)F
Canonical SMILES
C=CC(=O)OCC(C(C(F)(F)F)(F)F)(F)F
Isomeric SMILES
C=CC(=O)OCC(C(C(F)(F)F)(F)F)(F)F
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C7H5F7O2
Heavy Atom Count
16
Molecular Weight
254.101
Exact Molecular Weight
254.0178
Valence Electrons
94
Radical Electrons
0
tPSA
26.3
MolLogP
2.5485
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 21 20  0  0  0  0  0  0  0  0999 V2000
    3.8367    1.0966    0.7847 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9865    0.7036   -0.1362 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8545   -0.1745    0.1367 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6848   -0.5753    1.3150 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9683   -0.5829   -0.8279 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1349   -1.4091   -0.6620 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2195   -0.9428    0.2319 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8399    0.3636   -0.1994 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9304    0.7198    0.8015 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4136    0.8560    2.0723 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9222   -0.2442    0.8221 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5364    1.9195    0.4449 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9445    1.3912   -0.2548 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3863    0.1878   -1.4321 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7967   -0.9015    1.5348 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2689   -1.8846    0.2246 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.6571    1.7356    0.5758 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6541    0.7238    1.8052 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1232    1.0407   -1.1453 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2334   -2.4289   -0.3337 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6052   -1.5944   -1.6696 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
  9 11  1  0
  9 12  1  0
  8 13  1  0
  8 14  1  0
  7 15  1  0
  7 16  1  0
  1 17  1  0
  1 18  1  0
  2 19  1  0
  6 20  1  0
  6 21  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers