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
1.9260 -0.7584 0.1192 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1770 0.3192 -0.0625 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4398 0.2488 -0.6616 S 0 0 0 0 0 6 0 0 0 0 0 0
-0.7803 1.4378 -1.5176 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6178 -0.9702 -1.5445 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6442 0.2251 0.6653 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9318 -0.7278 0.4907 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5503 -1.7729 -0.1061 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6269 1.2699 0.1846 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7059 1.2477 1.0739 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6341 0.0024 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3900 -0.5217 1.4173 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