Monomers

Hexafluoro-1,3-butadiene

Identifiers

IUPAC name
1,1,2,3,4,4-hexafluorobuta-1,3-diene
InchI
InChI=1S/C4F6/c5-1(3(7)8)2(6)4(9)10
InchI Key
LGPPATCNSOSOQH-UHFFFAOYSA-N
SMILES
FC(=C(F)F)C(=C(F)F)F
Canonical SMILES
C(=C(F)F)(C(=C(F)F)F)F
Isomeric SMILES
C(=C(F)F)(C(=C(F)F)F)F
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C4F6
Heavy Atom Count
10
Molecular Weight
162.032
Exact Molecular Weight
161.9904
Valence Electrons
58
Radical Electrons
0
tPSA
0.0
MolLogP
3.1416
H Bond Acceptors
0
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

 10  9  0  0  0  0  0  0  0  0999 V2000
   -0.9257    0.1534   -1.5339 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6393   -0.1353   -0.2567 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5679   -0.6699    0.4946 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3739   -0.9989    1.8037 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7959   -0.9310    0.0055 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.6688    0.1407    0.2716 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5794    0.6828   -0.5250 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3357    0.9894   -1.8145 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.7970    0.9321   -0.0077 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.9217   -0.1632    1.5623 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  3
  3  4  1  0
  3  5  1  0
  2  6  1  0
  6  7  2  3
  7  8  1  0
  7  9  1  0
  6 10  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers