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
2.0446 0.4926 0.4721 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4264 -0.6416 0.2578 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0157 -0.6863 -0.7134 S 0 0 0 0 0 6 0 0 0 0 0 0
-0.7056 -2.0115 -0.5861 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3709 -0.4454 -2.1509 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1129 0.6036 -0.2603 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2168 0.3148 0.3942 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6635 1.4099 0.0471 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9390 0.4883 1.0802 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7933 -1.5573 0.6729 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8709 1.6296 -0.5243 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4296 -0.7075 0.6414 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8861 1.1109 0.6695 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