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
-1.3778 0.5967 -1.0748 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9898 -0.5845 -0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1242 -0.7298 0.6718 S 0 0 0 0 0 6 0 0 0 0 0 0
-0.6483 -0.4103 1.9409 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7085 -2.1046 0.7344 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4358 0.4465 0.5127 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0853 0.6816 -1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0019 1.4852 -0.5933 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3504 -1.4795 -1.1172 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0345 1.4736 0.4227 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0789 0.2171 -0.3465 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0716 0.4080 1.4203 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