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
   -5.0034    0.0064   -0.6740 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1867   -0.7487    0.0118 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8324   -0.3537    0.3243 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0084   -1.1933    1.0552 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7071   -0.8626    1.3799 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1598    0.3399    0.9839 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9752    1.1809    0.2555 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2814    0.8478   -0.0699 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1429    0.7109    1.2889 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2312    0.4348    0.4951 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6088    1.3237   -0.4678 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7016    1.0503   -1.2676 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3801   -0.1345   -1.0556 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0016   -1.0383   -0.0817 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9218   -0.7527    0.6979 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7787    0.9801   -1.0769 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0307   -0.3246   -0.8953 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5455   -1.7089    0.3575 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4329   -2.1446    1.3717 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0688   -1.5229    1.9511 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5580    2.1361   -0.0658 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8780    1.5326   -0.6376 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0834    2.2712   -0.6528 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0353    1.7393   -2.0511 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2408   -0.3787   -1.6655 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5258   -1.9731    0.0956 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5736   -1.4174    1.4775 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