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
   -4.8552   -1.4583    0.1793 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1266   -0.8979   -0.7549 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8318   -0.2708   -0.5196 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2733   -0.2253    0.7390 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0285    0.3806    0.9495 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3148    0.9520   -0.0811 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8756    0.9054   -1.3399 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1022    0.3072   -1.5418 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9237    1.5533    0.1361 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1238    0.9020    0.0651 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7846    0.8548   -1.1535 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0075    0.1966   -1.2465 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5142   -0.3877   -0.1050 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8604   -0.3403    1.0981 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6342    0.3175    1.1999 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8070   -1.9014   -0.0861 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5760   -1.5116    1.1990 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4885   -0.8832   -1.7977 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7901   -0.6567    1.5763 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6021    0.4080    1.9485 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3263    1.3485   -2.1504 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5507    0.2682   -2.5400 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3312    1.3313   -1.9996 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5295    0.1577   -2.2031 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4638   -0.9006   -0.1702 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2516   -0.7971    2.0015 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1239    0.3478    2.1643 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