Monomers

Phenyl vinyl sulfide

Identifiers

IUPAC name
ethenylsulfanylbenzene
InchI
InChI=1S/C8H8S/c1-2-9-8-6-4-3-5-7-8/h2-7H,1H2
InchI Key
GMPDOIGGGXSAPL-UHFFFAOYSA-N
SMILES
C=CSc1ccccc1
Canonical SMILES
C=CSC1=CC=CC=C1
Isomeric SMILES
C=CSC1=CC=CC=C1
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H8S
Heavy Atom Count
9
Molecular Weight
136.219
Exact Molecular Weight
136.0347
Valence Electrons
46
Radical Electrons
0
tPSA
0.0
MolLogP
2.9222
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
1

MOL File


     RDKit          3D

 17 17  0  0  0  0  0  0  0  0999 V2000
   -3.4755    0.2109    0.3689 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6828   -0.1640   -0.6101 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3784   -1.3493   -0.4023 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.1795   -0.5820   -0.0194 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3550    0.7771    0.1022 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5966    1.3289    0.4036 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6389    0.4655    0.5748 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5241   -0.9138    0.4650 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2689   -1.4048    0.1644 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3593   -0.1979    1.3577 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2509    0.9320    0.1929 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8223    0.2634   -1.5938 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5116    1.4030   -0.0458 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7312    2.3977    0.4985 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6299    0.8539    0.8121 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3936   -1.5493    0.6130 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1632   -2.4711    0.0759 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9  4  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  5 13  1  0
  6 14  1  0
  7 15  1  0
  8 16  1  0
  9 17  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers