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
    5.1797    0.3671    0.0372 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0411    0.9569   -0.1680 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7349    0.3135   -0.0133 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5667    1.0460   -0.2615 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3566    0.4287   -0.1119 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2163   -0.8875    0.2732 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3834   -1.5739    0.5078 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6409   -1.0054    0.3739 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0044   -1.5213    0.4274 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1473   -0.7861    0.1790 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6779   -0.7635   -1.0904 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8317   -0.0279   -1.3654 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4349    0.6823   -0.3300 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9154    0.6688    0.9443 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7887   -0.0621    1.1672 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2371   -0.6523    0.3400 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1106    0.9114   -0.0984 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0262    2.0064   -0.4786 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6410    2.0769   -0.5642 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5962    0.9538   -0.2930 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3126   -2.6044    0.8104 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5250   -1.6243    0.5808 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1922   -1.3196   -1.8672 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2609   -0.0000   -2.3576 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3464    1.2729   -0.5128 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4170    1.2329    1.7096 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3594   -0.0894    2.1616 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