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
1.6337 0.4475 -0.0067 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5687 -0.9239 0.4730 S 0 0 0 0 0 4 0 0 0 0 0 0
0.1937 -0.7791 1.9532 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8862 -0.7974 -0.5345 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7498 0.1871 -0.3321 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7678 0.3769 -1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1443 1.4087 0.2464 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6224 0.3928 0.4769 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0336 -1.5399 -1.3014 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6132 0.9395 0.4352 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6479 0.2877 -0.9342 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