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
    2.8731    1.3248   -0.7076 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0842    0.3336    0.1148 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0468   -0.6009    0.5393 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3126   -1.5375    1.3352 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7378   -0.5255    0.1099 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2808   -1.3910    0.4868 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6245   -1.1562   -0.0751 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3075    0.1202    0.2004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6488    1.3773   -0.2468 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4494    2.4934    0.0784 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4614    1.6286    0.4606 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3607    1.4671   -1.5696 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5733    0.1111   -0.4198 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6195    0.2969    1.5494 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6479   -1.4288   -1.4605 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4559   -2.1780    0.4381 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.8966    1.4886   -1.1107 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6707    1.9799   -0.9853 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0856    0.1558    0.5356 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3211   -1.5446    1.6085 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0435   -2.4151    0.1237 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