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
1.6707 0.2495 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4057 -0.5035 -1.0005 S 0 0 0 0 0 4 0 0 0 0 0 0
0.8159 -1.7992 -1.6299 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1679 -0.5406 -0.2379 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8208 0.5892 0.0185 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2909 0.7856 0.8681 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1866 1.0189 -0.6502 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4534 -0.4674 0.2969 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6162 -1.4799 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4121 1.5626 -0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8063 0.5850 0.4951 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