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
    3.6227    0.8452   -0.1735 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6312   -0.0277   -0.2230 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5304   -0.3421    1.1394 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1601   -0.2900    0.5543 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8165    0.9149    0.5799 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1338    0.9765    0.1284 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7819   -0.1461   -0.3397 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0973   -1.3422   -0.3535 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7954   -1.4245    0.0882 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8236    1.4352    0.7309 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2703    1.0165   -1.0046 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4771   -0.5833   -1.1401 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3119    1.7958    0.9458 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6598    1.9127    0.1427 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8005   -0.1427   -0.6982 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5548   -2.2559   -0.7098 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2433   -2.3425    0.0870 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