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
1.6345 0.5420 0.2322 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6366 -0.8683 -0.2119 S 0 0 0 0 0 4 0 0 0 0 0 0
0.7650 -1.2744 -1.6505 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0124 -0.7228 0.3523 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8579 0.1547 -0.1649 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6987 0.3233 -0.0053 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3212 1.4751 -0.2214 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5693 0.6517 1.3377 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3669 -1.3648 1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5144 0.8070 -0.9682 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8736 0.2766 0.1502 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