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
2.2279 0.5248 -0.6516 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0827 0.4782 0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1009 -0.9600 0.1339 S 0 0 0 0 0 6 0 0 0 0 0 0
0.2737 -1.4737 1.5502 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5282 -2.0190 -0.8194 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6000 -0.5939 -0.0498 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0325 0.6468 -0.2439 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6715 -0.3102 -1.1648 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7668 1.4629 -0.6792 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6968 1.3658 0.4967 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2875 -1.4276 0.0022 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3359 1.4731 -0.2942 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0925 0.8329 -0.3530 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