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
    5.2483   -0.1732    0.3779 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1224   -0.1960    1.0324 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8309   -0.1147    0.3731 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6481   -0.1435    1.1304 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4149   -0.0680    0.5304 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2737    0.0395   -0.8396 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4132    0.0702   -1.6078 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6599   -0.0079   -0.9777 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9533    0.1173   -1.4717 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1592    0.0955   -0.7949 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7231    1.2732   -0.3718 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9204    1.2720    0.3021 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6077    0.1121    0.5849 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0276   -1.0629    0.1529 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8284   -1.0729   -0.5231 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1831   -0.2374    0.9249 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2639   -0.0922   -0.6884 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1110   -0.2793    2.1282 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7176   -0.2278    2.2182 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4819   -0.0910    1.1191 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3892    0.1523   -2.6825 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5315    0.0200   -1.6248 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2280    2.2122   -0.5661 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3911    2.1920    0.6497 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5650    0.1229    1.1248 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5518   -2.0017    0.3637 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3700   -2.0001   -0.8644 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