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
-2.5388 -0.3645 -0.4452 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4384 0.1019 0.1307 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1346 -0.1334 -0.5828 S 0 0 0 0 0 6 0 0 0 0 0 0
0.2149 0.4910 -1.9592 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4224 -1.6091 -0.6944 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3415 0.6690 0.4017 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4282 0.0634 0.8247 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5162 -0.2174 -0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4506 -0.9139 -1.3988 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5494 0.6371 1.0647 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1689 1.7054 0.6628 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1605 0.5583 1.4249 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6223 -0.9877 0.5712 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