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
2.0303 0.9032 -0.0607 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1002 0.2960 0.6497 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1754 -1.0398 -0.0513 S 0 0 0 0 0 6 0 0 0 0 0 0
-0.0871 -2.0292 1.0519 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9213 -1.7122 -1.1370 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3901 -0.4710 -0.6168 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0741 0.4273 0.0773 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5751 1.7133 0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2745 0.6288 -1.0812 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9169 0.6291 1.6601 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7606 -0.8883 -1.5499 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0302 0.7385 -0.3205 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6517 0.8042 0.9979 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