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
    3.9986    0.4979   -0.9444 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4055    0.3016    0.2129 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9465    0.3106    0.3561 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4945    0.1116    1.5098 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1053    0.5234   -0.7027 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2833    0.5388   -0.6671 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8938   -0.7772   -0.3250 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3982   -0.7858   -0.2975 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0434    0.1329    0.6671 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6388   -0.1698    1.9529 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8215    1.4490    0.3453 F   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4235   -0.0440    0.5975 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8627   -0.5477   -1.5808 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7769   -2.0992   -0.0006 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4165   -1.2658    0.8693 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5605   -1.7332   -1.3102 F   0  0  0  0  0  0  0  0  0  0  0  0
    5.0564    0.4859   -1.0182 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3624    0.6709   -1.8113 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0192    0.1290    1.0803 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5984    1.3201    0.0933 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6710    0.9511   -1.6318 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