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
-2.0222 0.5881 0.3097 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3527 -0.5202 0.5242 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0090 -0.8872 -0.4942 S 0 0 0 0 0 6 0 0 0 0 0 0
-0.5322 -1.0654 -1.9051 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6771 -2.1767 -0.1225 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1594 0.4324 -0.5257 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1559 0.4736 0.3302 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8908 0.8643 0.9269 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7470 1.2719 -0.4805 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6487 -1.1784 1.3146 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0312 1.2142 -1.2667 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8726 1.2884 0.3164 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2885 -0.3050 1.0726 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