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
-2.1267 -0.1791 -0.4135 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9184 0.3280 -0.5648 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2653 0.0949 0.6939 S 0 0 0 0 0 6 0 0 0 0 0 0
-0.1064 -1.0730 1.5472 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2450 1.3145 1.5963 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8643 -0.1111 -0.0436 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3910 -0.7331 0.4738 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8328 -0.0067 -1.2287 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6107 0.8898 -1.4376 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5023 0.7060 0.2934 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7941 -0.1476 -1.1644 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3152 -1.0826 0.2480 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