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
   -4.9978   -0.3627   -0.3558 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1835    0.6037   -0.0602 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8096    0.3426    0.3046 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2397   -0.9036    0.3755 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8991   -1.0920    0.7361 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1284    0.0103    1.0290 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6603    1.2806    0.9704 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9721    1.4099    0.6137 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2213   -0.1394    1.3949 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2409   -0.1394    0.4741 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6373   -1.3292   -0.0878 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6657   -1.3707   -1.0236 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2871   -0.1980   -1.3836 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8797    0.9998   -0.8104 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8596    1.0255    0.1152 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6903   -1.3836   -0.3423 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0186   -0.1442   -0.6251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5464    1.6238   -0.0891 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8320   -1.7815    0.1482 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5035   -2.0946    0.7756 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0301    2.1359    1.2067 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4188    2.4097    0.5598 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1350   -2.2318    0.2110 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9900   -2.2859   -1.4733 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0756   -0.2226   -2.0999 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4033    1.8903   -1.1305 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5346    1.9472    0.5667 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