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
-1.5597 1.2600 -0.1776 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1436 0.0734 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0420 -0.7789 0.3791 S 0 0 0 0 0 6 0 0 0 0 0 0
0.0054 -2.2677 0.0737 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1573 -0.6291 1.8519 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7013 -0.2421 0.0143 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2942 1.7944 -0.7458 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1606 1.7131 0.7117 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5442 -0.3796 -1.4375 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7476 0.8520 -0.0361 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3425 -0.6424 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0207 -0.7533 -0.9177 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