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
1.9495 -0.0884 -0.6224 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1130 -0.4172 0.3209 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3532 0.4560 0.6624 S 0 0 0 0 0 6 0 0 0 0 0 0
-0.7043 0.3510 2.1247 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1250 1.8972 0.3368 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7354 -0.1671 -0.2568 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8507 -0.6644 -0.7967 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8296 0.7579 -1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3333 -1.2827 0.9343 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4440 -0.4764 -1.2927 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2402 -1.0187 0.2693 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4739 0.6527 -0.3836 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