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
1.7381 0.0205 0.4118 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4667 0.6359 -0.6816 S 0 0 0 0 0 4 0 0 0 0 0 0
0.1440 2.0827 -0.4484 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9377 -0.4054 -0.7616 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8968 -0.3313 0.1458 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5484 0.7860 0.4371 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3711 -0.1718 1.4306 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1854 -0.9021 -0.0273 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0156 -1.1200 -1.5707 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8279 0.3850 0.9646 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7757 -0.9796 0.0997 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