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
-2.1228 -0.2576 0.1302 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9555 -0.3703 -0.4561 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3379 0.7189 -0.0314 S 0 0 0 0 0 6 0 0 0 0 0 0
0.0902 1.4036 1.2713 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4866 1.7010 -1.1649 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8192 -0.2480 0.1444 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2926 0.4952 0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9176 -0.9254 -0.1295 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7561 -1.1371 -1.2177 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0799 -0.7574 -0.8161 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5913 -1.0342 0.9152 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6394 0.4114 0.4876 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