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
    4.4025    0.4679    0.0522 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4526   -0.3359    0.4587 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0767   -0.2525   -0.0716 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7999    0.6095   -0.9364 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0961   -1.0904    0.3554 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2471   -1.1440   -0.0338 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0455    0.0869    0.2680 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4665   -0.1905   -0.2288 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3612    0.9939    0.0277 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8556    2.0948   -0.6404 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4772    1.2283    1.3839 F   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6209    0.6622   -0.4298 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3842   -0.3737   -1.5949 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9048   -1.3214    0.3833 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5708    1.2115   -0.3624 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0671    0.3403    1.6318 F   0  0  0  0  0  0  0  0  0  0  0  0
    5.3869    0.3732    0.4630 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1384    1.2065   -0.6978 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6783   -1.0818    1.2025 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3559   -1.4483   -1.1160 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6745   -2.0366    0.5185 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