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
    4.8172    0.8790   -0.6610 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0462    0.5442    0.3393 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7179   -0.0292    0.1865 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1621   -0.2672   -1.0438 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8883   -0.8172   -1.1493 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1723   -1.1285   -0.0167 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7298   -0.8898    1.2183 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9850   -0.3478    1.3167 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1150   -1.6843   -0.1467 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1563   -0.7611   -0.1994 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7794   -0.3427    0.9594 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8132    0.5725    0.9190 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2194    1.0674   -0.2973 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5983    0.6527   -1.4727 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5756   -0.2532   -1.4285 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4888    0.7390   -1.6672 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7976    1.3022   -0.5011 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4165    0.7024    1.3609 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7053   -0.0309   -1.9724 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4797   -0.9919   -2.1353 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1846   -1.1270    2.1283 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4201   -0.1616    2.3130 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4669   -0.7259    1.9167 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2919    0.8912    1.8328 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0368    1.7927   -0.3444 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9114    1.0360   -2.4258 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0472   -0.6209   -2.2962 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