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
    5.1853   -0.0825    0.4843 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0534    0.1950    1.0614 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7827   -0.0000    0.3958 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5979    0.3099    1.0501 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3725    0.1470    0.4734 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3011   -0.3454   -0.8119 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4377   -0.6704   -1.5115 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6769   -0.4888   -0.8846 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9372   -0.5248   -1.4332 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1284   -0.2222   -0.7987 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6932    1.0283   -0.8915 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8795    1.3277   -0.2590 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5299    0.3641    0.4887 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9860   -0.9100    0.6029 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8065   -1.1611   -0.0425 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2301   -0.4665   -0.5059 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1037    0.0808    1.0232 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0431    0.5897    2.0836 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6701    0.7010    2.0732 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5645    0.3874    0.9789 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4206   -1.0598   -2.5231 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5642   -0.7605   -1.4774 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2274    1.8256   -1.4652 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3184    2.3327   -0.3430 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4703    0.5860    0.9956 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5241   -1.6326    1.1950 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3739   -2.1551    0.0414 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