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
-1.6581 0.4597 -0.4001 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6236 -0.7354 0.4051 S 0 0 0 0 0 4 0 0 0 0 0 0
-0.6661 -0.7022 1.8918 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0050 -0.8093 -0.2289 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8747 0.1724 -0.0569 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4577 1.5082 -0.0808 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7264 0.2024 -0.1496 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5347 0.3405 -1.4969 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3105 -1.6839 -0.7783 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5957 1.0849 0.5018 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8807 0.1626 -0.4306 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