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
    3.1307    0.4112   -0.3974 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5893   -0.7770   -0.6219 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4151   -1.3665    0.6208 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1500   -0.5684    0.2372 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0313   -1.2138   -0.6358 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2300   -0.5950   -0.9251 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5206    0.6260   -0.3524 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6258    1.2502    0.5154 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4235    0.6392    0.8113 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8947    1.0107    0.4772 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8423    0.7792   -1.1413 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8309   -1.3520   -1.4835 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7593   -2.1719   -1.0610 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9469   -1.0510   -1.5939 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4609    1.0900   -0.5922 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8659    2.1993    0.9527 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3113    1.0899    1.4867 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