Monomers

p-Phenoxystyrene

Identifiers

IUPAC name
1-ethenyl-4-phenoxybenzene
InchI
InChI=1S/C14H12O/c1-2-12-8-10-14(11-9-12)15-13-6-4-3-5-7-13/h2-11H,1H2
InchI Key
UULPGUKSBAXNJN-UHFFFAOYSA-N
SMILES
C=Cc1ccc(cc1)Oc1ccccc1
Canonical SMILES
C=CC1=CC=C(C=C1)OC2=CC=CC=C2
Isomeric SMILES
C=CC1=CC=C(C=C1)OC2=CC=CC=C2
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C14H12O
Heavy Atom Count
15
Molecular Weight
196.249
Exact Molecular Weight
196.0888
Valence Electrons
74
Radical Electrons
0
tPSA
9.23
MolLogP
4.1219
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
2
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
2

MOL File


     RDKit          3D

 27 28  0  0  0  0  0  0  0  0999 V2000
   -4.9230    0.4069    0.7321 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0825    0.8828   -0.1406 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7724    0.3039   -0.3622 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2888   -0.7918    0.3166 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0241   -1.3341    0.0883 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2113   -0.7587   -0.8550 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6547    0.3362   -1.5552 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9117    0.8579   -1.3135 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0446   -1.2657   -1.1089 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1445   -0.7827   -0.3814 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5474   -1.3589    0.8061 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6229   -0.9067    1.5420 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3444    0.1883    1.0673 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9520    0.7733   -0.1185 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8722    0.3041   -0.8387 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9079    0.8692    0.8753 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7501   -0.4483    1.3742 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3715    1.7451   -0.7251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9193   -1.2543    1.0622 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6758   -2.1984    0.6420 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0072    0.7669   -2.2908 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2524    1.7159   -1.8659 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9828   -2.2056    1.1652 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9285   -1.3751    2.4812 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1832    0.5346    1.6491 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5237    1.6222   -0.4717 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5919    0.7941   -1.7740 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  6  9  1  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  2  0
 13 14  1  0
 14 15  2  0
  8  3  1  0
 15 10  1  0
  1 16  1  0
  1 17  1  0
  2 18  1  0
  4 19  1  0
  5 20  1  0
  7 21  1  0
  8 22  1  0
 11 23  1  0
 12 24  1  0
 13 25  1  0
 14 26  1  0
 15 27  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers