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
2.0854 0.8584 -0.3439 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3098 -0.1980 -0.4929 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1285 -0.5928 0.7389 S 0 0 0 0 0 6 0 0 0 0 0 0
0.5279 -1.9545 1.2849 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1288 0.4280 1.8430 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4809 -0.7154 0.0638 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1372 0.3577 -0.3336 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9810 1.4681 0.5395 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8285 1.1411 -1.0774 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4328 -0.7928 -1.3855 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9716 -1.6754 -0.0418 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7068 1.3721 -0.2598 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1261 0.3036 -0.7508 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