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
-1.2869 -0.9057 0.7468 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6143 -0.2481 -0.7836 S 0 0 0 0 0 4 0 0 0 0 0 0
-1.6925 0.2700 -1.7084 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6655 0.9113 -0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8725 0.4788 -0.2025 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3850 -0.9609 0.6465 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8183 -1.8819 0.9024 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0034 -0.2400 1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5085 2.0048 -0.5519 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0564 -0.5754 -0.1418 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6976 1.1471 -0.0165 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