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
    5.1969   -0.0016   -0.2192 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1221    0.4945    0.3526 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7871    0.1024   -0.0572 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5678   -0.8024   -1.0588 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2874   -1.1627   -1.4342 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2256   -0.5945   -0.7815 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4256    0.3230    0.2346 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7015    0.6827    0.6094 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0605   -0.9690   -1.1725 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1919   -0.4331   -0.5541 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7866    0.7194   -1.0273 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9030    1.2352   -0.4051 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4757    0.6398    0.7024 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8854   -0.5129    1.1801 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7658   -1.0275    0.5537 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1686    0.3223    0.1217 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1483   -0.7118   -1.0070 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2141    1.2264    1.1637 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3828   -1.2855   -1.6119 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1012   -1.8825   -2.2307 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4425    0.7562    0.7333 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8634    1.4093    1.4139 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3326    1.1841   -1.8985 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3556    2.1409   -0.7914 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3522    1.0650    1.1723 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3280   -0.9849    2.0468 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3127   -1.9332    0.9394 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