Monomers
Divinyl sulfone
Identifiers
IUPAC name
1-ethenylsulfonylethene
InchI
InChI=1S/C4H6O2S/c1-3-7(5,6)4-2/h3-4H,1-2H2
InchI Key
AFOSIXZFDONLBT-UHFFFAOYSA-N
SMILES
C=CS(=O)(=O)C=C
Canonical SMILES
C=CS(=O)(=O)C=C
Isomeric SMILES
C=CS(=O)(=O)C=C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C4H6O2S
Heavy Atom Count
7
Molecular Weight
118.157
Exact Molecular Weight
118.0089
Valence Electrons
40
Radical Electrons
0
tPSA
34.14
MolLogP
0.6882
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
13 12 0 0 0 0 0 0 0 0999 V2000
1.8893 -0.7099 0.2372 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4161 0.1475 -0.6331 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0654 1.0517 -0.4298 S 0 0 0 0 0 6 0 0 0 0 0 0
-0.7468 1.1227 -1.7672 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2192 2.4195 0.1310 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1680 0.2553 0.6817 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9221 -0.7386 0.2557 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8039 -1.2233 0.0379 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3487 -0.8867 1.1449 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9654 0.3232 -1.5488 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2631 0.5428 1.7179 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8817 -1.0834 -0.7725 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5954 -1.2209 0.9451 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 2 0
3 6 1 0
6 7 2 3
1 8 1 0
1 9 1 0
2 10 1 0
6 11 1 0
7 12 1 0
7 13 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers