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
2.3688 0.3537 0.3551 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3972 -0.3563 -0.2004 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1369 -0.5354 0.5900 S 0 0 0 0 0 6 0 0 0 0 0 0
-0.2440 0.5329 1.6695 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2403 -1.8532 1.3067 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4788 -0.4273 -0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1553 0.7026 -0.6433 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3497 0.4774 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1786 0.8185 1.3151 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6152 -0.8142 -1.1682 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7892 -1.2727 -1.1077 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9868 0.7997 -1.3137 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8781 1.5742 -0.0646 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