Monomers
Divinyl sulfone
Identifiers
IUPAC name
1-ethenylsulfonylethene
InchI
InChI=1S/C4H6O2S/c1-3-7(5,6)4-2/h3-4H,1-2H2
InchI Key
AFOSIXZFDONLBT-UHFFFAOYSA-N
SMILES
C=CS(=O)(=O)C=C
Canonical SMILES
C=CS(=O)(=O)C=C
Isomeric SMILES
C=CS(=O)(=O)C=C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C4H6O2S
Heavy Atom Count
7
Molecular Weight
118.157
Exact Molecular Weight
118.0089
Valence Electrons
40
Radical Electrons
0
tPSA
34.14
MolLogP
0.6882
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
13 12 0 0 0 0 0 0 0 0999 V2000
2.2591 -1.1381 0.0726 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9510 -1.1979 0.2206 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0485 0.0115 -0.5038 S 0 0 0 0 0 6 0 0 0 0 0 0
0.7664 1.2933 -0.5951 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3895 -0.3354 -1.9464 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5004 0.3238 0.3881 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9480 1.5582 0.4777 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7483 -0.3543 -0.4907 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9402 -1.8822 0.5129 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5043 -1.9922 0.7874 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0419 -0.4821 0.8712 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8448 1.8505 1.0124 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3961 2.3449 -0.0090 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
6 7 2 3
1 8 1 0
1 9 1 0
2 10 1 0
6 11 1 0
7 12 1 0
7 13 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers