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
-1.6401 -0.5078 -0.0976 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4377 0.7321 -0.5765 S 0 0 0 0 0 4 0 0 0 0 0 0
-1.0291 2.1147 -0.4547 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0267 0.5211 0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9593 -0.2983 -0.0503 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6420 -0.0701 0.1165 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3455 -1.0574 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7733 -1.1838 -0.9533 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1527 1.0577 1.2846 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8735 -0.4479 0.5151 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8555 -0.8603 -0.9818 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