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
   -4.7681    1.4936   -0.6079 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0122    1.0385    0.3651 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7624    0.3421    0.1879 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0432   -0.0968    1.2766 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8419   -0.7676    1.1500 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3572   -0.9992   -0.1183 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0607   -0.5686   -1.2217 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2790    0.1110   -1.0743 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8441   -1.6666   -0.3468 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0517   -0.9852   -0.4333 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5279   -0.5074   -1.6410 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7145    0.1574   -1.6985 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4755    0.3752   -0.5654 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0188   -0.0931    0.6489 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8178   -0.7677    0.7177 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7133    2.0176   -0.3880 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4846    1.3668   -1.6400 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3740    1.2095    1.3881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4539    0.1027    2.2497 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2761   -1.1128    2.0059 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6951   -0.7416   -2.2313 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7728    0.4177   -1.9899 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9117   -0.6882   -2.5338 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0461    0.5142   -2.6752 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4216    0.9137   -0.6590 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6120    0.0749    1.5431 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4528   -1.1401    1.6779 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