Monomers
Methyl vinyl sulfone
Identifiers
IUPAC name
1-methylsulfonylethene
InchI
InChI=1S/C3H6O2S/c1-3-6(2,4)5/h3H,1H2,2H3
InchI Key
WUIJTQZXUURFQU-UHFFFAOYSA-N
SMILES
C=CS(=O)(=O)C
Canonical SMILES
CS(=O)(=O)C=C
Isomeric SMILES
CS(=O)(=O)C=C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C3H6O2S
Heavy Atom Count
6
Molecular Weight
106.146
Exact Molecular Weight
106.0089
Valence Electrons
36
Radical Electrons
0
tPSA
34.14
MolLogP
0.1745
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
12 11 0 0 0 0 0 0 0 0999 V2000
1.2937 0.8466 -1.2617 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0252 -0.4112 -0.9289 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0502 -0.8243 0.3833 S 0 0 0 0 0 6 0 0 0 0 0 0
-0.5411 -2.2298 0.1683 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6217 -0.7758 1.7137 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4500 0.2763 0.4306 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9687 1.0496 -2.0851 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8274 1.6698 -0.6974 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5077 -1.1861 -1.5132 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1264 1.3378 0.2386 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1344 0.0049 -0.3981 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9424 0.2422 1.4204 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
1 7 1 0
1 8 1 0
2 9 1 0
6 10 1 0
6 11 1 0
6 12 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers