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
    3.6569    0.1421   -1.0899 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1156   -0.6404   -0.1888 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8659   -0.2833    0.4898 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3852   -1.0744    1.3524 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1896    0.8742    0.2320 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0069    1.3465    0.7537 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2790    0.7523    0.3905 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6104   -0.6536    0.6135 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0834   -0.8914    0.1354 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9127   -0.0864    0.8571 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1817   -0.6441   -1.2060 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3151   -2.2163    0.3534 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5592   -1.1517    1.8590 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8958   -1.4367   -0.3188 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4716    1.0901   -0.9799 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2759    1.5170    1.0620 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.1407    1.0797   -1.3216 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5825   -0.1296   -1.5878 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5882   -1.5607    0.0636 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1061    1.5306    1.8715 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0528    2.4359    0.3794 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