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
-2.1472 -0.1403 0.3655 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9633 -0.5457 -0.0461 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3280 0.5777 -0.4223 S 0 0 0 0 0 6 0 0 0 0 0 0
0.0701 1.9271 0.1825 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3222 0.7743 -1.9258 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8463 -0.1264 0.1317 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8974 -0.8827 0.5799 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3562 0.9162 0.4839 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7277 -1.5957 -0.1731 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6689 -0.0028 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0842 0.3321 1.1169 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7721 -1.2338 0.3060 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