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
    3.8893    0.9249    0.4690 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1970   -0.0817   -0.0168 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7965   -0.2465    0.3575 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2924    0.5921    1.1434 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0012   -1.2493   -0.0893 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2935   -1.5968    0.0832 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4182   -0.8821   -0.5500 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6078    0.5660   -0.2926 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8806    1.0760   -1.0036 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9833    0.3990   -0.5425 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7768    0.9361   -2.3706 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0463    2.4216   -0.7411 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7149    0.9043    1.0154 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5370    1.3106   -0.8438 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3968   -1.1507   -1.9283 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6373   -1.4904   -0.1355 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.9290    1.0796    0.2147 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4581    1.6633    1.1566 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6850   -0.7661   -0.6852 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5835   -1.7060    1.1854 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3725   -2.7039   -0.2365 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