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
    4.7772    0.1809    0.1182 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5578    0.2292   -0.3821 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3626    0.0292    0.4031 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4319   -0.2062    1.6312 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1194    0.0943   -0.1885 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0836   -0.0858    0.4925 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2825    0.0421   -0.4138 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5716   -0.1612    0.3688 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7804   -0.0366   -0.5225 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8257    1.2176   -1.1022 F   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8968   -0.1838    0.2780 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7574   -1.0007   -1.5174 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6964    0.7850    1.3711 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5848   -1.4164    0.9293 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2982    1.2193   -1.0995 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2012   -0.9860   -1.3396 F   0  0  0  0  0  0  0  0  0  0  0  0
    5.6656    0.3297   -0.4660 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8872   -0.0186    1.1690 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4580    0.4340   -1.4582 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1420   -1.1073    0.9573 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1392    0.6413    1.3425 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