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
   -4.6727   -0.3036    1.1331 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2331   -0.0537   -0.0699 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8289    0.0330   -0.3967 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4460    0.3040   -1.7071 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1240    0.3994   -2.0827 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1223    0.2264   -1.1560 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4735   -0.0424    0.1459 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8226   -0.1369    0.5154 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2294    0.3190   -1.5162 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2133    0.1424   -0.5725 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6822    1.2341    0.1324 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6804    1.0609    1.0911 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1813   -0.1969    1.3179 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7263   -1.2809    0.6285 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7479   -1.1108   -0.3110 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9914   -0.4566    1.9382 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7266   -0.3601    1.3358 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9681    0.0996   -0.8801 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2250    0.4470   -2.4696 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8361    0.6092   -3.0984 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3092   -0.1837    0.9001 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0521   -0.3503    1.5526 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2590    2.2114   -0.0778 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0218    1.9424    1.6231 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9541   -0.3327    2.0598 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1503   -2.2734    0.8363 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3672   -1.9467   -0.8723 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