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
-1.9459 -0.0083 -0.5013 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3288 0.6456 -0.3960 S 0 0 0 0 0 4 0 0 0 0 0 0
-0.0035 1.8071 -1.2429 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9510 -0.5238 -0.1669 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1687 -0.0879 0.0935 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5173 0.4979 -1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4935 0.1887 0.4596 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0122 -1.0992 -0.6821 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7995 -1.5946 -0.2271 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9731 -0.7876 0.2385 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4089 0.9622 0.1713 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