Monomers

Vinyl ethyl sulfoxide

Identifiers

IUPAC name
1-ethenylsulfinylethane
InchI
InChI=1S/C4H8OS/c1-3-6(5)4-2/h3H,1,4H2,2H3
InchI Key
HNXMKNMCALMEPP-UHFFFAOYSA-N
SMILES
CCS(=O)C=C
Canonical SMILES
CCS(=O)C=C
Isomeric SMILES
CCS(=O)C=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C4H8OS
Heavy Atom Count
6
Molecular Weight
104.174
Exact Molecular Weight
104.0296
Valence Electrons
36
Radical Electrons
0
tPSA
17.07
MolLogP
0.8985
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

 14 13  0  0  0  0  0  0  0  0999 V2000
   -2.2736    0.2180   -0.2969 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9579    0.0310    0.4719 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3428    0.6155   -0.6193 S   0  0  0  0  0  4  0  0  0  0  0  0
    0.2184    0.0992   -2.0148 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9392    0.4859    0.0788 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4273   -0.7068    0.3675 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6067    1.2587   -0.2684 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0441   -0.5021    0.0578 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0317   -0.0382   -1.3493 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8408   -1.0441    0.6456 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9736    0.6037    1.4108 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5097    1.3836    0.2666 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4109   -0.7880    0.7977 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8802   -1.6166    0.1905 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  2  3
  1  7  1  0
  1  8  1  0
  1  9  1  0
  2 10  1  0
  2 11  1  0
  5 12  1  0
  6 13  1  0
  6 14  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers