Monomers

Phenyl vinyl ether

Identifiers

IUPAC name
ethenoxybenzene
InchI
InChI=1S/C8H8O/c1-2-9-8-6-4-3-5-7-8/h2-7H,1H2
InchI Key
NHOGGUYTANYCGQ-UHFFFAOYSA-N
SMILES
C=COc1ccccc1
Canonical SMILES
C=COC1=CC=CC=C1
Isomeric SMILES
C=COC1=CC=CC=C1
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H8O
Heavy Atom Count
9
Molecular Weight
120.151
Exact Molecular Weight
120.0575
Valence Electrons
46
Radical Electrons
0
tPSA
9.23
MolLogP
2.2089
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
   -3.1515    0.1131    0.8820 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3227    0.5874   -0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4906   -0.2463   -0.7458 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1050   -0.2182   -0.5045 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7483   -1.0337   -1.2163 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0895   -0.9931   -0.9689 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6301   -0.1400   -0.0049 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7741    0.6742    0.7050 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4174    0.6257    0.4472 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7793    0.7808    1.4308 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2065   -0.9372    1.0689 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2608    1.6444   -0.2067 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3278   -1.7039   -1.9730 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7485   -1.6433   -1.5396 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6833   -0.1298    0.1670 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1719    1.3542    1.4684 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2745    1.2657    1.0023 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