Monomers
Vinyl ethyl sulfoxide
Identifiers
IUPAC name
1-ethenylsulfinylethane
InchI
InChI=1S/C4H8OS/c1-3-6(5)4-2/h3H,1,4H2,2H3
InchI Key
HNXMKNMCALMEPP-UHFFFAOYSA-N
SMILES
CCS(=O)C=C
Canonical SMILES
CCS(=O)C=C
Isomeric SMILES
CCS(=O)C=C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C4H8OS
Heavy Atom Count
6
Molecular Weight
104.174
Exact Molecular Weight
104.0296
Valence Electrons
36
Radical Electrons
0
tPSA
17.07
MolLogP
0.8985
H Bond Acceptors
1
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
14 13 0 0 0 0 0 0 0 0999 V2000
-1.9574 0.1915 0.0223 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0393 -0.9924 -0.0559 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5497 -0.5466 -0.7320 S 0 0 0 0 0 4 0 0 0 0 0 0
0.3812 -0.1491 -2.1697 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3731 0.6786 0.2407 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5691 0.3912 0.7041 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7229 0.7943 0.9197 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7719 0.8248 -0.8666 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0020 -0.1726 -0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4979 -1.7350 -0.7343 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9661 -1.4865 0.9375 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9454 1.6446 0.4717 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0344 -0.5552 0.5009 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1046 1.1124 1.3019 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 2 0
3 5 1 0
5 6 2 3
1 7 1 0
1 8 1 0
1 9 1 0
2 10 1 0
2 11 1 0
5 12 1 0
6 13 1 0
6 14 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers