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
    5.1986   -0.6018   -0.0233 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0308   -1.1152   -0.2425 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7610   -0.4454   -0.0170 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7188    0.8398    0.4678 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4871    1.4737    0.6806 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3097    0.8124    0.4051 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3358   -0.4768   -0.0816 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5666   -1.0653   -0.2772 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9074    1.4652    0.6253 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1122    0.8603    0.3707 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7797    0.9085   -0.8199 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9852    0.2913   -1.0418 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5388   -0.4116    0.0045 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9029   -0.4939    1.2383 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6934    0.1429    1.4130 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3095    0.3985    0.3570 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0958   -1.1636   -0.2160 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9984   -2.1435   -0.6317 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6028    1.4020    0.6994 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4822    2.4924    1.0654 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6084   -0.9605   -0.2849 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5842   -2.0894   -0.6639 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3470    1.4600   -1.6434 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5330    0.3142   -1.9731 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4863   -0.9155   -0.1183 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3901   -1.0591    2.0129 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1969    0.0805    2.3713 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