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
2.0717 0.7010 -0.0618 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8738 0.3733 -0.5172 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2093 -0.5357 0.5001 S 0 0 0 0 0 6 0 0 0 0 0 0
0.1294 -2.0056 0.3114 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0570 -0.1792 1.9319 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8817 -0.1874 0.0823 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3458 0.3950 0.9312 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7745 1.2694 -0.6718 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5917 0.6837 -1.5286 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3193 -1.1423 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4488 0.0120 1.0174 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9848 0.6159 -0.6706 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