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
-2.1656 0.0047 -0.1922 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9170 -0.0512 -0.6175 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3641 0.4757 0.4403 S 0 0 0 0 0 6 0 0 0 0 0 0
0.0193 0.2690 1.8924 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5652 1.9617 0.2379 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8377 -0.4240 0.0286 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9967 -0.3106 -0.8106 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4004 0.3708 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7406 -0.4257 -1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5650 -1.3546 -0.5049 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5145 0.1494 -0.6397 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3546 -0.6653 0.9836 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