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
    4.1662    0.9565   -0.9148 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4638   -0.0871   -0.5329 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1167    0.1251   -0.0251 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6804    1.2966    0.0274 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2903   -0.8781    0.4013 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0021   -0.8038    0.8973 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0388   -0.2421   -0.0060 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3572   -0.2692    0.7625 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4831    0.2878   -0.0835 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5913   -0.4969   -1.2203 F   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6559    0.1287    0.6270 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2086    1.5930   -0.3509 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1833    0.5151    1.8835 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6494   -1.5412    1.1664 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8063    1.0044   -0.4845 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2134   -1.1264   -1.0726 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.7835    1.9641   -0.8666 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1630    0.8112   -1.2916 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9096   -1.0728   -0.6080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3152   -1.8664    1.1237 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0730   -0.2984    1.8918 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