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
-1.7971 0.1996 0.4228 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0693 -0.7845 -0.0045 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5484 -0.6394 -0.6508 S 0 0 0 0 0 6 0 0 0 0 0 0
1.3576 -1.8246 -0.2017 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4434 -0.5914 -2.1543 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3679 0.8233 -0.1026 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7859 0.0301 0.8074 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4264 1.2109 0.4019 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4706 -1.8031 0.0281 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1633 1.6924 -0.7602 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4771 0.6315 -0.1918 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1915 1.0552 0.9621 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