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
-1.5693 -0.4393 -0.0251 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4890 0.8021 0.5327 S 0 0 0 0 0 4 0 0 0 0 0 0
-0.9967 2.1866 0.6303 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1985 0.6054 0.1828 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7139 -0.5087 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0882 -1.1760 -0.7281 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4144 -0.0076 -0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0285 -0.9651 0.8379 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8587 1.4586 0.3492 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0437 -1.3623 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7713 -0.5936 -0.4747 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