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
    4.3311   -0.7831   -0.3031 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4912    0.2106   -0.4627 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1211    0.0254    0.0319 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7344   -1.0138    0.5839 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1884    1.0287   -0.1034 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1182    1.0399    0.2885 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0719    0.0574   -0.2542 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4380    0.3592    0.3958 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3935   -0.6652   -0.1813 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9487   -1.9339    0.1376 F   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6730   -0.5058    0.3070 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3836   -0.4724   -1.5598 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3737    0.2833    1.7550 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8427    1.6177   -0.0090 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3309    0.2131   -1.6126 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7822   -1.2217    0.0869 F   0  0  0  0  0  0  0  0  0  0  0  0
    5.3599   -0.6624   -0.6669 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0587   -1.7132    0.1684 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7605    1.1324   -0.9299 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5465    2.0774    0.1407 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1423    0.9265    1.4157 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