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
    3.7687    1.0703   -0.0238 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6938   -0.2367    0.0409 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4231   -0.9478    0.0655 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3909   -2.1864    0.1272 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2344   -0.2445    0.0202 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0359   -0.8662    0.0403 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0999    0.2057   -0.0224 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4897   -0.3536   -0.0065 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4448    0.8411   -0.0746 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7558    0.4043   -0.0641 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1471    1.5850   -1.1790 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2458    1.5507    1.0954 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7322   -1.2684   -0.9785 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7283   -0.9551    1.2161 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8701    0.9949   -1.1328 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9328    1.0283    1.0752 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.8840    1.6817   -0.0620 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7321    1.5456   -0.0393 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5998   -0.8265    0.0782 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1095   -1.4609    0.9737 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1349   -1.5615   -0.8010 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