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
-1.5560 0.5011 0.1084 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5293 -0.7328 0.8704 S 0 0 0 0 0 4 0 0 0 0 0 0
-1.1207 -2.1134 0.5746 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1517 -0.6576 0.3793 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7729 0.4442 0.0158 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0659 1.4887 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9846 0.1261 -0.8432 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4391 0.6648 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6995 -1.5908 0.3817 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2579 1.4078 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8137 0.4618 -0.2833 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