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
2.2593 0.1886 0.1856 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1216 0.2207 -0.5009 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1014 -0.9937 -0.2052 S 0 0 0 0 0 6 0 0 0 0 0 0
-0.2329 -1.8752 -1.4264 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2908 -1.8483 0.9869 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6706 -0.2556 0.0518 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8095 1.0267 0.3246 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4326 -0.5832 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0499 0.9087 0.0481 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9174 0.9765 -1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5686 -0.8526 -0.0106 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7856 1.4393 0.4748 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9030 1.6480 0.3913 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