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
    2.1700    1.9808   -2.3818 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8255    0.7750   -1.9898 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4184    0.5306   -0.5881 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3962    1.4616    0.2396 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0534   -0.7305   -0.1601 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6578   -1.0613    1.1126 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5684   -0.4668    1.6805 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8605   -0.7518    0.9924 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9992   -0.3403   -0.4216 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3136   -0.6845   -0.8201 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8274    0.9843   -0.6723 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1651   -1.1388   -1.2229 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8629   -0.1257    1.7564 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1516   -2.1296    1.0315 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7279   -1.0045    2.9880 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4867    0.9155    1.8444 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.4695    2.1963   -3.3848 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1490    2.7792   -1.6644 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8486   -0.0200   -2.7124 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4827   -2.1901    1.1025 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4922   -0.9794    1.8730 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