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
-1.5726 0.3701 -0.3492 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4240 -0.3907 0.7707 S 0 0 0 0 0 4 0 0 0 0 0 0
-0.9512 -1.6044 1.4701 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1844 -0.5853 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7049 0.4367 -0.5615 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3160 1.4419 -0.4765 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6230 -0.0944 -1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5897 0.2912 0.0964 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7211 -1.5209 0.2258 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7031 0.3121 -0.9781 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1630 1.3438 -0.6763 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