Monomers
Ethene, (methylsulfinyl)-
Identifiers
IUPAC name
1-methylsulfinylethene
InchI
InChI=1S/C3H6OS/c1-3-5(2)4/h3H,1H2,2H3
InchI Key
UDDBCWCQRQREBI-UHFFFAOYSA-N
SMILES
CS(=O)C=C
Canonical SMILES
CS(=O)C=C
Isomeric SMILES
CS(=O)C=C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C3H6OS
Heavy Atom Count
5
Molecular Weight
90.147
Exact Molecular Weight
90.0139
Valence Electrons
30
Radical Electrons
0
tPSA
17.07
MolLogP
0.5084
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
11 10 0 0 0 0 0 0 0 0999 V2000
-1.8644 -0.1560 0.1884 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4079 0.6487 -0.4104 S 0 0 0 0 0 4 0 0 0 0 0 0
-0.1484 0.5190 -1.8634 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9931 0.4715 0.6203 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0026 -0.2725 0.2131 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7800 0.3931 -0.1158 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9064 -1.1824 -0.2485 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7936 -0.2092 1.3096 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0664 0.9544 1.5927 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9718 -0.7699 -0.7451 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8668 -0.3966 0.8212 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 0
2 4 1 0
4 5 2 3
1 6 1 0
1 7 1 0
1 8 1 0
4 9 1 0
5 10 1 0
5 11 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers