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
    5.0056    0.6258   -0.6710 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4486   -0.3150    0.0208 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0083   -0.4763    0.1277 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4625   -1.5146    0.8917 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1003   -1.6148    0.9547 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2384   -0.7389    0.2993 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8043    0.2603   -0.4366 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1778    0.3847   -0.5169 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0715   -0.9324    0.4286 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2054   -0.2278    0.2747 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3234    1.1427    0.2433 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5552    1.7904    0.0729 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7156    1.0681   -0.0714 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6182   -0.3057   -0.0417 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4116   -0.9406    0.1249 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1152    0.6415   -0.6730 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5141    1.3782   -1.2324 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0496   -1.0592    0.5771 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1214   -2.1974    1.4025 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6317   -2.4209    1.5475 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2137    0.9857   -1.0025 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5658    1.2150   -1.1282 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4201    1.7447    0.3755 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5768    2.8780    0.0567 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6836    1.5484   -0.2051 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5374   -0.8916   -0.1554 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3385   -2.0283    0.1479 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