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
    3.2834    1.2183   -0.0974 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3828   -0.0635   -0.3397 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2378   -0.9540   -0.2958 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3681   -2.1873   -0.5350 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9547   -0.5348    0.0021 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1586   -1.3846    0.0476 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4335   -0.6304    0.4027 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6960    0.4529   -0.6535 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9673    1.1624   -0.2476 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7651    1.7098    0.9953 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2765    2.1795   -1.1163 F   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0108    0.2598   -0.1430 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8189   -0.1370   -1.8899 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6526    1.3355   -0.5953 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5295   -1.4692    0.3523 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3693   -0.0398    1.6221 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.3170    1.6740    0.1515 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1157    1.9076   -0.1220 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3427   -0.4827   -0.5811 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0541   -2.1748    0.8324 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2698   -1.8415   -0.9571 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