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
    3.5199    0.3336   -0.5650 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3054    0.5259   -0.0251 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4048   -0.5209    0.0280 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0413   -0.3566    0.0669 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5363    0.8899    0.0554 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9172    1.0063    0.0960 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7294   -0.1026    0.1479 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1514   -1.3556    0.1595 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7736   -1.4598    0.1187 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7744   -0.6485   -0.9530 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2239    1.1540   -0.6059 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0551    1.5061    0.3607 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0636    1.7890    0.0152 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3530    2.0037    0.0860 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8085   -0.0258    0.1799 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7652   -2.2613    0.2002 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3536   -2.4775    0.1297 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