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
2.0639 0.7440 -0.2233 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9007 0.5994 0.3621 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1883 -0.7405 0.0235 S 0 0 0 0 0 6 0 0 0 0 0 0
-0.2616 -1.6094 1.2563 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2906 -1.5368 -1.1572 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8371 -0.1580 -0.3205 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6826 1.5805 0.0245 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4022 0.0300 -0.9499 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5881 1.3352 1.0895 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0247 -0.1480 -1.4153 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0470 0.8131 0.1572 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5693 -0.9096 0.0974 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