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
    0.3494   -1.3841   -1.1045 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.5737   -0.3652   -0.2452 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8088   -0.1055    0.0871 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8297   -0.8208   -0.4029 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.0476    0.9056    0.9415 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5628    0.3691    0.2494 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8026    0.1067   -0.0856 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8520    0.8119    0.3934 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0688   -0.9053   -0.9433 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3229    1.3875    1.1100 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