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
2.2342 0.3838 0.4185 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0979 0.5248 -0.2521 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0667 -0.8113 -0.6374 S 0 0 0 0 0 6 0 0 0 0 0 0
0.6623 -2.1077 -0.1280 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0786 -0.9923 -2.1359 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5326 -0.5801 0.0055 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0400 0.6193 0.1602 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8782 1.1952 0.6626 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5624 -0.6120 0.7579 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8069 1.5189 -0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1096 -1.4384 0.2788 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5102 1.5406 -0.0965 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0376 0.7590 0.5614 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