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
    4.4549    0.0674   -0.4362 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3460    0.7399   -0.1274 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0802    0.0677    0.0996 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0174   -1.1722    0.0058 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9722    0.7936    0.4129 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3104    0.3559    0.6575 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0147   -0.3189   -0.4788 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3971   -0.7697   -0.1461 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3646    0.2750    0.2705 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5808   -0.3989    0.5099 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6358    1.1803   -0.7325 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0241    0.9132    1.4633 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3010   -1.7443    0.8556 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9200   -1.4366   -1.2382 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3038   -1.4758   -0.8203 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9895    0.4906   -1.6061 F   0  0  0  0  0  0  0  0  0  0  0  0
    5.3732    0.6047   -0.5966 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4761   -1.0042   -0.5343 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3964    1.8160   -0.0451 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3647   -0.2748    1.5890 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9100    1.2911    0.8977 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