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
-2.0583 0.0330 0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4499 0.5180 -0.4346 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0978 -0.0696 -1.0037 S 0 0 0 0 0 6 0 0 0 0 0 0
-0.0828 -1.2326 -1.9557 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8049 1.0079 -1.7763 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0901 -0.6266 0.3089 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1073 0.0951 0.7197 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0147 0.4324 0.9371 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5806 -0.7717 1.1824 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9049 1.3062 -0.9881 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8736 -1.5592 0.7849 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7714 -0.1867 1.5323 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3460 1.0538 0.2451 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