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
2.4530 0.7578 -0.0326 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4444 0.1472 -0.6312 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1010 -0.5113 0.2585 S 0 0 0 0 0 6 0 0 0 0 0 0
0.1712 -0.1042 1.7111 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1951 -2.0119 0.2314 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4369 -0.0202 -0.4371 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5451 -0.1961 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4305 0.8441 1.0422 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2982 1.1757 -0.5535 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4375 0.0440 -1.7124 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5071 0.4298 -1.4192 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5230 -0.6412 1.2225 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5188 0.0863 -0.1381 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