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
   -4.0937    0.4721    0.6859 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5451   -0.3837   -0.1344 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0845   -0.6201   -0.1141 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5530   -1.4431   -0.9022 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2517    0.0344    0.7494 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1155   -0.0574    0.9043 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9726    0.3049   -0.2528 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4325    0.1191    0.1956 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2910    0.4991   -1.0150 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0032    1.8163   -1.3286 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.6270    0.3460   -0.7504 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.8816   -0.3330   -2.0474 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.7499    0.9280    1.2442 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.6999   -1.2015    0.4788 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.8403    1.6147   -0.6638 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.8136   -0.5938   -1.2866 F   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1489    0.6437    0.6721 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4870    1.0175    1.3890 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1095   -0.9535   -0.8559 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3817    0.6134    1.7781 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4645   -1.0660    1.2541 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