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
    3.3448    0.0823    0.4336 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9741   -1.1455    0.1490 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5609   -1.5050    0.1633 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1845   -2.6951   -0.1113 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6162   -0.5668    0.4728 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7563   -0.9090    0.4885 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6333    0.2498    0.8491 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5063    1.4041   -0.1048 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8729    1.0458   -1.5253 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1720    0.6058   -1.6259 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7866    2.2032   -2.2854 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0453    0.1243   -2.0995 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2331    1.9350   -0.0271 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3713    2.4195    0.2806 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1881    0.7181    2.0910 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9270   -0.2069    0.9369 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.3803    0.3845    0.4330 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6001    0.8376    0.6815 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7364   -1.8816   -0.0953 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8770   -1.6624    1.3211 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0280   -1.4377   -0.4258 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