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
1.7347 -0.2878 -0.0777 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3044 0.2274 -1.0102 S 0 0 0 0 0 4 0 0 0 0 0 0
-0.2150 -0.8220 -1.9514 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0041 0.8192 0.0065 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7311 -0.0289 0.6963 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5350 -0.5370 -0.8021 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5471 -1.1131 0.6179 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0838 0.5766 0.5142 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1955 1.9022 0.0493 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5338 -1.0785 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5255 0.3419 1.3122 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