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
-1.8369 -0.1790 0.1844 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9749 0.1037 -1.0463 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4739 1.0074 -0.5219 S 0 0 0 0 0 4 0 0 0 0 0 0
0.0435 2.3210 0.0925 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4427 0.1151 0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4677 -0.6480 0.3408 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3502 -0.9583 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0700 0.7432 0.7447 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8166 -0.5935 -0.1575 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6082 0.6851 -1.7338 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7481 -0.8534 -1.5253 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1595 0.2136 1.6853 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0021 -1.1566 1.1242 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8154 -0.8001 -0.6700 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