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
    4.3028    0.0191    0.8495 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4891   -0.3769   -0.1025 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1041    0.1170   -0.0864 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7189    0.9009    0.8240 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1912   -0.2520   -1.0490 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1396    0.1497   -1.1237 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0300   -0.2588   -0.0029 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4214    0.2728   -0.2810 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3887   -0.1033    0.8193 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9887    0.4069    2.0467 F   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6033    0.4905    0.5255 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5311   -1.4518    0.9593 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4042    1.6444   -0.4016 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9206   -0.2584   -1.4551 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1390   -1.6550   -0.0679 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6070    0.0724    1.2365 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.9278    0.6890    1.6052 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3444   -0.3045    0.9045 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8707   -1.0462   -0.8540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2341    1.2543   -1.3391 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5412   -0.3099   -2.0820 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