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
-2.2076 0.5769 -0.0133 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4897 -0.3279 -0.6532 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0114 -0.8650 0.0581 S 0 0 0 0 0 6 0 0 0 0 0 0
-0.2508 -1.0499 1.5409 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4505 -2.1624 -0.5557 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2071 0.3896 -0.2003 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3886 0.3611 0.4151 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8188 0.9408 0.9317 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1607 0.9514 -0.4142 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8763 -0.6925 -1.5971 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0221 1.2240 -0.8666 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1337 1.1304 0.2626 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5904 -0.4764 1.0918 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