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
    3.6818    0.2491   -0.9328 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0225    1.0605   -0.1348 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7938    0.6214    0.5806 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1926    1.4275    1.3345 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3071   -0.6381    0.4346 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1968   -1.2235    0.9736 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1646   -0.9161    0.5305 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7218    0.4390    0.5972 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1815    0.3588    0.0808 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9301   -0.4837    0.8420 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1027   -0.0425   -1.2364 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7205    1.6267    0.1830 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0820    1.2462   -0.3569 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6975    1.0286    1.8207 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0109   -1.7177    1.3552 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3423   -1.3843   -0.7952 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.3118   -0.7575   -1.0632 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5572    0.5289   -1.4556 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3414    2.0661    0.0322 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2281   -1.1287    2.1125 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3209   -2.3606    0.8332 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