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
    4.8723    0.9959   -0.1314 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1381    0.0228    0.3389 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7669   -0.2450   -0.0400 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1239    0.5457   -0.9615 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7957    0.2886   -1.3305 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1219   -0.7610   -0.7714 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7348   -1.5753    0.1563 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0397   -1.2946    0.4959 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1884   -1.0388   -1.1156 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2092   -0.4423   -0.3816 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6620    0.7795   -0.8314 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6812    1.3857   -0.1072 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2011    0.7700    1.0117 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7340   -0.4564    1.4481 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7231   -1.0655    0.7360 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4678    1.6741   -0.8576 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8890    1.1548    0.1817 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5952   -0.6452    1.0797 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5839    1.3984   -1.4537 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3074    0.9144   -2.0509 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1903   -2.4204    0.6055 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5455   -1.9184    1.2222 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2597    1.2696   -1.7082 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0382    2.3515   -0.4638 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9987    1.2882    1.5430 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1329   -0.9464    2.3207 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3437   -2.0300    1.0649 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