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
-1.8070 0.1030 -0.0181 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3583 -0.5004 0.8170 S 0 0 0 0 0 4 0 0 0 0 0 0
-0.1050 0.1324 2.1436 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0492 -0.6384 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8932 0.3455 -0.4324 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7039 -0.2085 0.5596 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8497 -0.3407 -1.0239 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7891 1.2009 -0.1174 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2372 -1.5851 -0.6995 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6994 1.2880 0.0556 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7339 0.2032 -1.0706 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