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
-1.4943 -0.5714 0.2035 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5956 0.9924 0.2018 S 0 0 0 0 0 4 0 0 0 0 0 0
-1.2747 2.0088 -0.6931 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0445 0.6550 -0.3743 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7498 -0.2559 0.2704 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2698 -0.5649 0.9771 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7674 -1.4089 0.3755 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9324 -0.7702 -0.8045 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4249 1.1953 -1.2289 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7553 -0.4910 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3597 -0.7892 1.1224 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