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
2.5556 -0.0994 -0.3531 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3314 -0.1925 -0.8626 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0076 0.4752 0.0394 S 0 0 0 0 0 6 0 0 0 0 0 0
0.2173 0.1194 1.4980 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0842 1.9675 -0.0484 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5368 -0.1524 -0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4993 -0.2524 0.4628 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4383 -0.4982 -0.8668 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7562 0.3762 0.6012 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2292 -0.6845 -1.8209 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7633 -0.4707 -1.4557 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4758 -0.6367 0.2086 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3447 0.0485 1.5004 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