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
1.6841 0.6216 -0.0694 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1635 -0.5601 -0.3855 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5156 -0.8955 -0.1001 S 0 0 0 0 0 6 0 0 0 0 0 0
-1.1903 -1.5013 -1.3166 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6156 -1.8731 1.0229 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3825 0.6080 0.3039 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7237 0.8653 -0.2326 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0518 1.3818 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7669 -1.3454 -0.8282 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1742 0.8620 1.3422 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0566 1.4252 -0.3895 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4551 0.4116 0.0869 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