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
-2.1393 -0.2602 0.3842 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9590 -0.5869 -0.0888 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2980 0.5843 -0.4373 S 0 0 0 0 0 6 0 0 0 0 0 0
0.4202 0.6484 -1.9407 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0546 1.9518 0.0354 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8467 0.0119 0.1939 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4032 0.7711 0.5878 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8782 -1.0212 0.5817 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7160 -1.6254 -0.2854 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1734 0.5512 1.1028 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6565 0.0613 -0.5696 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7555 -1.0863 0.4360 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