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
    4.0425    0.1297    0.2641 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4403   -0.8409   -0.4036 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9876   -0.7708   -0.6860 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4255   -1.6947   -1.3192 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2215    0.2914   -0.2700 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1568    0.4826   -0.4618 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0555   -0.5075    0.1695 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4991   -0.2066   -0.1174 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0050    1.0997    0.3555 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4292    2.2223   -0.1311 F   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3770    1.1356    0.1163 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7987    1.1344    1.7468 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2278   -1.1921    0.5667 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7288   -0.3658   -1.4883 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8043   -1.8187   -0.1862 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8981   -0.4372    1.5622 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.4898    0.9861    0.6138 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0977    0.0442    0.4502 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9658   -1.6946   -0.7579 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3691    1.5296   -0.0836 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3215    0.4731   -1.5745 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