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
2.3843 0.0995 -0.1151 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1004 0.3835 -0.2094 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0674 -0.9067 -0.0516 S 0 0 0 0 0 6 0 0 0 0 0 0
0.3023 -1.6725 1.2003 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0679 -1.8339 -1.2454 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6822 -0.3197 0.1491 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9922 0.9290 0.4287 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1251 0.8973 -0.2119 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6953 -0.9405 0.0605 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8097 1.4134 -0.3827 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4941 -1.0268 0.0372 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2343 1.7152 0.5599 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0148 1.2622 0.5476 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