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
    4.2737    0.8208   -0.2530 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4648    0.1047    0.4703 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0761   -0.1033   -0.0114 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7016    0.4046   -1.0927 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1961   -0.8496    0.7202 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1249   -1.1421    0.4386 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0242    0.0580    0.4126 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4184   -0.4594    0.0993 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4158    0.6833    0.0487 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6548    0.1593   -0.2370 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4289    1.3396    1.2504 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0420    1.4933   -1.0002 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8509   -1.3454    1.0659 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3658   -1.1167   -1.1119 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6226    1.0007   -0.4866 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0192    0.6337    1.6788 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.9300    1.2483   -1.1803 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2885    0.9735    0.0977 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7589   -0.3423    1.4008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4953   -1.8992    1.1708 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2268   -1.6618   -0.5616 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