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
   -4.6823   -0.5660   -0.5745 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1700    0.4167    0.1057 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7525    0.5645    0.3302 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8382   -0.3235   -0.1593 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4800   -0.0942    0.1124 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0570    0.9864    0.8482 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9906    1.8742    1.3358 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3188    1.6516    1.0711 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2948    1.2187    1.1212 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2091    0.3209    0.6255 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6043   -0.7866    1.3420 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5207   -1.6856    0.8440 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0743   -1.4806   -0.4248 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6988   -0.3808   -1.1672 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7782    0.4863   -0.6204 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0628   -1.3239   -1.0066 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7664   -0.6329   -0.7164 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8643    1.1581    0.5203 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1353   -1.1761   -0.7364 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2390   -0.8125   -0.2854 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6694    2.7518    1.9312 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0365    2.3786    1.4747 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1907   -0.9654    2.3232 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8118   -2.5412    1.4234 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7984   -2.1737   -0.8409 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1265   -0.2167   -2.1550 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4773    1.3520   -1.1951 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