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
    4.9636    0.3513   -0.8019 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2348   -0.1097    0.1701 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8456    0.2355    0.3094 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1669    1.0602   -0.5410 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8080    1.3465   -0.3329 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1070    0.8146    0.7257 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8065   -0.0162    1.5754 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1450   -0.3066    1.3822 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2358    1.0715    0.9677 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2655    0.2978    0.4472 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7152   -0.7821    1.1782 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7365   -1.5598    0.6750 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3260   -1.2916   -0.5415 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8632   -0.2028   -1.2645 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8406    0.5853   -0.7729 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0005    0.0728   -0.8766 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5597    1.0080   -1.5405 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7047   -0.7824    0.9017 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6645    1.5029   -1.3838 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3170    1.9927   -1.0176 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2862   -0.4522    2.4190 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6331   -0.9690    2.0910 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2541   -1.0093    2.1522 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0743   -2.4155    1.2817 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1294   -1.9038   -0.9366 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3099    0.0342   -2.2298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4929    1.4279   -1.3479 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