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
2.3548 -0.0764 0.5348 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0460 -0.3211 0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1204 0.9101 0.3197 S 0 0 0 0 0 6 0 0 0 0 0 0
-0.3222 1.8541 1.4931 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4799 1.7582 -0.7864 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6439 0.2764 -0.1873 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9103 -1.0066 -0.1931 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1054 -0.8160 0.7639 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6834 0.8763 0.1605 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7230 -1.2785 1.0817 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4122 0.9487 -0.5131 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1395 -1.6948 0.1347 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8440 -1.4305 -0.5013 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