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
-1.8589 -0.0897 -0.0338 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3235 0.7287 -0.4188 S 0 0 0 0 0 4 0 0 0 0 0 0
-0.3417 2.2081 -0.1567 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0133 -0.0333 0.4299 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0345 -0.4861 -0.2736 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6850 0.5907 -0.3119 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8944 -0.3962 1.0331 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8800 -1.0344 -0.6478 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0476 -0.1538 1.5061 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8835 -0.9659 0.2219 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0047 -0.3682 -1.3484 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