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
    3.8586    0.4974   -0.5066 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6773   -0.5288    0.3086 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3486   -0.9578    0.7209 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1737   -1.9303    1.4936 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2203   -0.2984    0.2682 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0969   -0.6993    0.6578 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0528    0.2499   -0.0320 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4909   -0.0585    0.2919 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3325    0.9731   -0.4690 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6826    0.7641   -0.2282 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1461    0.8360   -1.8312 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0379    2.2516   -0.0386 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7488    0.1374    1.6355 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8806   -1.3130   -0.0464 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8728    0.2353   -1.3906 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7981    1.5404    0.4014 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.8418    0.7814   -0.7854 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9815    1.0150   -0.8625 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5138   -1.0909    0.7017 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1831   -0.6654    1.7515 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2926   -1.7391    0.3246 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