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
    4.3927   -0.3356    0.7156 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4554   -0.3384   -0.2017 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1050    0.0866    0.1657 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8477    0.4521    1.3551 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0651    0.1136   -0.7335 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2556    0.4898   -0.5036 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0330   -0.3282    0.4627 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4433    0.1152    0.6798 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3337    0.1253   -0.5085 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5888    0.5581   -0.0759 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9769    1.0241   -1.4960 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4647   -1.1077   -1.0733 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0101   -0.7848    1.5928 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4422    1.3422    1.3106 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4646   -0.4425    1.7193 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1094   -1.6558   -0.0114 F   0  0  0  0  0  0  0  0  0  0  0  0
    5.4106   -0.6448    0.4828 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2175   -0.0314    1.7435 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6903   -0.6491   -1.1971 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2592    1.5426   -0.1525 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8027    0.4686   -1.4908 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