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
cid=

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
   -3.1282    0.3693    0.3570 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3910    0.2355   -0.7247 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3803   -0.7039   -0.7355 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0681   -0.4260   -0.4155 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3307    0.8350   -0.0559 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6657    1.0770    0.2606 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6107    0.0660    0.2209 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1900   -1.2033   -0.1450 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8572   -1.4360   -0.4589 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9577   -0.2450    1.2426 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9384    1.0818    0.4447 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6124    0.8719   -1.5604 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3497    1.6798   -0.0012 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0257    2.0566    0.5499 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6546    0.2211    0.4607 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8943   -2.0211   -0.1890 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5969   -2.4589   -0.7383 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