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
1.9431 0.0140 0.0019 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3776 0.6668 0.4808 S 0 0 0 0 0 4 0 0 0 0 0 0
-0.0299 1.9274 -0.2171 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9148 -0.5165 0.5442 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1476 -0.1355 0.2809 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6868 0.2572 0.8096 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2640 0.4157 -0.9835 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8981 -1.1040 -0.0473 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7115 -1.5335 0.7923 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9392 -0.8710 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4266 0.8795 0.0221 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