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
-2.1251 -0.2762 0.0363 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9000 -0.4651 0.4512 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3285 0.7107 0.0654 S 0 0 0 0 0 6 0 0 0 0 0 0
0.5231 1.6902 1.1853 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0420 1.5095 -1.1543 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8225 -0.1842 -0.2998 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3618 0.6034 -0.5391 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8765 -1.0118 0.2818 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6526 -1.3406 1.0268 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0813 -0.7674 0.6166 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5493 -0.9375 -1.0772 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6533 0.4690 -0.5930 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