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
    2.6926    1.8627   -1.0058 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6590    0.9804   -0.0106 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7209   -0.1359   -0.0090 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7273   -0.9404    0.9507 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8123   -0.3550   -1.0263 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1172   -1.3681   -1.1308 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1923   -1.4728   -0.1277 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1617   -0.3623    0.0105 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5652    0.9465    0.3618 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8763    0.8533    1.5532 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8479    1.5129   -0.6657 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6642    1.8219    0.6291 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0070   -0.7089    1.0862 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0259   -0.2715   -1.0808 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9674   -2.6116   -0.4677 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6966   -1.7408    1.1619 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.3957    2.6752   -0.9785 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0393    1.8055   -1.8559 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3476    1.1011    0.8140 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3645   -2.3855   -1.2966 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6373   -1.2068   -2.1322 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