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
-2.3725 0.2870 0.2092 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1210 -0.5895 0.2128 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2729 0.4920 0.4755 S 0 0 0 0 0 4 0 0 0 0 0 0
0.2487 1.5543 -0.6187 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8065 -0.3808 0.5052 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8841 0.1282 -0.0781 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4951 0.6801 -0.8234 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1988 1.1863 0.8531 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2493 -0.2225 0.6023 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2635 -1.3043 1.0736 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0553 -1.1815 -0.7019 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8696 -1.3361 1.0014 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8517 1.0846 -0.5837 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8219 -0.3979 -0.0641 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