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
1.7215 0.5504 1.2422 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0851 0.0758 0.1872 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5354 0.5260 -0.2465 S 0 0 0 0 0 6 0 0 0 0 0 0
-1.2902 1.1827 0.8422 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4247 1.4635 -1.4406 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3924 -0.9304 -0.7726 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2128 1.2579 1.8752 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7231 0.2681 1.5048 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5750 -0.6388 -0.4676 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2301 -0.6417 -1.4418 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7070 -1.5871 -1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7377 -1.5266 0.0845 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