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
    4.0264    0.9387   -0.2053 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8639    0.5191   -0.6007 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8945    0.0373    0.3685 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1639    0.0165    1.6202 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6393   -0.4241    0.0248 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2395   -0.8745    1.0370 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5520   -1.3391    0.5036 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2317   -0.2227   -0.2333 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5204    0.9764    0.5831 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3477    0.6262    1.6557 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4618    1.6691    1.0751 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2322    1.8688   -0.2338 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3675    0.1524   -1.2786 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4165   -0.6630   -0.8024 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4358   -2.4741   -0.2710 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4073   -1.7098    1.5525 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.2799    0.9333    0.8334 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7453    1.2948   -0.9120 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6167    0.5273   -1.6435 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2935   -1.7778    1.4697 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3108   -0.0749    1.7904 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