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
    4.2389    0.6653    0.6080 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3788   -0.2566    0.2295 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9681    0.0393    0.0039 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5797    1.2143    0.1808 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0946   -0.9192   -0.3853 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2927   -0.7769   -0.6326 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1006   -0.3789    0.5502 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5485   -0.2748    0.2601 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9535    0.7164   -0.7707 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4117    0.4293   -1.9834 F   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3485    0.7085   -0.8146 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5116    1.9705   -0.3211 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2207    0.0186    1.4477 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0631   -1.5382   -0.1293 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8897   -1.3905    1.5106 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6895    0.8137    1.1430 F   0  0  0  0  0  0  0  0  0  0  0  0
    5.2638    0.3957    0.7599 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8581    1.6756    0.7504 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7360   -1.2629    0.0831 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6557   -1.7664   -0.9738 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4322   -0.0830   -1.5165 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