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
cid=

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
   -3.8671   -0.2215   -0.3224 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6794   -0.0756    0.2280 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3990   -1.2313   -0.0968 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.2283   -0.4939   -0.0666 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3394   -1.2746   -0.3040 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6293   -0.7812   -0.2983 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8131    0.5606   -0.0421 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7051    1.3749    0.2017 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4382    0.8406    0.1862 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6634    0.4805   -0.1320 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0554   -1.0546   -0.9760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4708    0.7657    0.8951 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1837   -2.3252   -0.5037 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4863   -1.4425   -0.4932 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7929    0.9823   -0.0284 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9180    2.4192    0.3961 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3993    1.4767    0.3747 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