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
-2.3646 0.1321 -0.4222 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0414 0.6722 0.0954 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1805 -0.6218 -0.0936 S 0 0 0 0 0 4 0 0 0 0 0 0
0.1392 -1.1749 -1.4880 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7700 -0.1719 0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8357 -0.4692 -0.2543 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9275 -0.2262 0.4481 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9138 0.8851 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1864 -0.7492 -1.0846 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1335 1.0193 1.1213 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7843 1.5294 -0.5697 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8776 0.3556 1.3839 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7250 -0.9941 -1.1791 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8234 -0.1863 0.0921 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