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
1.7261 0.8200 0.8079 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5826 -0.3900 0.3174 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1007 -0.9875 -0.3883 S 0 0 0 0 0 6 0 0 0 0 0 0
0.1587 -0.8894 -1.8882 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0834 -2.4059 0.0592 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2975 -0.0826 0.1543 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0198 0.6563 -0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6660 1.1239 1.2279 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8971 1.5062 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4130 -1.0745 0.3393 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5332 -0.1702 1.2194 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7451 0.7079 -1.7023 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8651 1.1859 -0.2675 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