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
-2.1852 0.7965 0.1426 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5978 -0.3829 0.0671 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0681 -0.5775 -0.7204 S 0 0 0 0 0 6 0 0 0 0 0 0
0.1784 -2.0289 -1.0623 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0051 0.1788 -2.0302 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2451 -0.0411 0.2785 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4329 0.1163 -0.2526 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7276 1.6907 -0.2887 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1419 0.9586 0.6268 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0861 -1.2450 0.5084 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0822 0.1660 1.3514 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6111 -0.0796 -1.2924 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2519 0.4482 0.3587 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