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
    5.2509    0.1708    0.6494 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2288   -0.1782   -0.0876 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8378    0.0387    0.2843 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4783    0.6411    1.4664 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1390    0.8305    1.7858 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1232    0.4332    0.9531 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4817   -0.1698   -0.2302 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8098   -0.3699   -0.5714 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1995    0.6311    1.2901 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2635    0.2622    0.5118 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7987   -1.0010    0.6835 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8707   -1.4489   -0.0609 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4512   -0.6426   -1.0121 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9129    0.6204   -1.1808 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8410    1.0750   -0.4401 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2605   -0.0248    0.3036 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1328    0.6533    1.6034 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4239   -0.6678   -1.0526 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2451    0.9706    2.1538 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8886    1.2995    2.7074 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2726   -0.5089   -0.9362 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1009   -0.8358   -1.4852 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4004   -1.7036    1.4141 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2880   -2.4509    0.0818 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3021   -0.9703   -1.6174 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3675    1.2663   -1.9333 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4334    2.0798   -0.5932 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