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
    4.4423    0.8738   -0.2831 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5093    0.0096    0.0670 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1228    0.2935   -0.1667 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8165    1.3852   -0.7132 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0871   -0.5807    0.1810 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2435   -0.1517   -0.1187 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2680   -1.1462    0.2877 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6355   -0.6871   -0.0331 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0944    0.5800    0.5950 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4078    0.7871    0.1375 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4020    1.7037    0.1328 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1704    0.5433    1.9602 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5271   -1.6832    0.3870 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7690   -0.5248   -1.4198 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0498   -2.3489   -0.3852 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1779   -1.4489    1.6339 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.2186    1.8128   -0.7503 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4864    0.6548   -0.1045 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7813   -0.9174    0.5318 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3430    0.0932   -1.1784 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3758    0.7518    0.5464 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