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
2.1277 0.1749 0.7973 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3300 -0.7595 0.3209 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0969 -0.3583 -0.8476 S 0 0 0 0 0 6 0 0 0 0 0 0
0.4060 0.9559 -1.5413 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0852 -1.4039 -1.9522 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4960 -0.2800 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1239 0.8562 0.1025 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0562 1.2137 0.4919 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8805 -0.0938 1.5162 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4339 -1.7783 0.6499 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9780 -1.2052 0.1703 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7180 1.8304 -0.1498 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1006 0.8480 0.5559 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