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
2.1092 0.1597 -0.0941 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9344 -0.1873 -0.6054 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4145 -0.6127 0.3989 S 0 0 0 0 0 6 0 0 0 0 0 0
-0.0547 -0.3957 1.8323 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8476 -2.0518 0.1893 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7519 0.5063 0.0084 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9551 0.4263 -0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2727 0.1911 0.9751 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8001 -0.2097 -1.6819 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1811 0.1328 -0.9618 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5204 0.5290 0.7986 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3012 1.5122 -0.1464 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