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
    3.1321   -4.0646   -1.2765 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8943   -2.7874   -1.4209 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7416   -2.1764   -0.8007 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8060   -2.9009   -0.1061 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2912   -2.2523    0.4752 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4462   -0.8925    0.3600 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4979   -0.1735   -0.3387 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5827   -0.7968   -0.9162 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5547   -0.2931    0.9553 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7171    1.0968    0.8681 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3796    1.6847   -0.1858 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5690    3.0436   -0.3229 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0430    3.8504    0.6894 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3718    3.2811    1.7608 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2130    1.9280    1.8463 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9999   -4.4885   -1.7525 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4944   -4.6886   -0.7039 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5889   -2.1645   -2.0304 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8581   -3.9685    0.0260 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0293   -2.8317    1.0242 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3674    0.8817   -0.4211 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3384   -0.2649   -1.4683 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7690    1.0131   -0.9473 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0959    3.4792   -1.1660 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1737    4.9150    0.6131 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9671    3.9382    2.5438 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6811    1.4698    2.6950 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