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
   -4.9449    0.6033    0.1259 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1442    0.0358   -0.7519 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7733   -0.3135   -0.4353 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1925   -0.0864    0.7953 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8722   -0.4455    1.0336 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0905   -1.0380    0.0642 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6559   -1.2716   -1.1703 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9606   -0.9131   -1.3954 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2102   -1.3960    0.2866 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2157   -0.4683    0.0182 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9233    0.7907   -0.4628 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9379    1.6661   -0.7114 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2322    1.2933   -0.4839 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5176    0.0221    0.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5088   -0.8826    0.2607 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9818    0.8597   -0.1366 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6619    0.8540    1.1348 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5116   -0.1800   -1.7413 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7552    0.3746    1.5938 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4336   -0.2529    2.0248 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0632   -1.7355   -1.9483 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4117   -1.0957   -2.3695 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8808    1.0752   -0.6403 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7101    2.6699   -1.0945 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0493    1.9804   -0.6776 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5466   -0.2664    0.1790 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7207   -1.8796    0.6402 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