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
1.9472 -0.0411 -0.2413 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3523 -0.6447 0.3607 S 0 0 0 0 0 4 0 0 0 0 0 0
-0.0130 -1.8790 -0.4569 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9109 0.5752 0.1004 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1768 0.1809 0.0122 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5758 -0.9085 -0.5487 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8224 0.5769 -1.1533 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5097 0.4941 0.5318 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6669 1.6256 0.0134 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4536 -0.8646 0.0953 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9862 0.8852 -0.1463 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