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
    5.2105    0.5438   -0.8766 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5002   -0.4973   -0.4773 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0551   -0.4789   -0.3018 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4259   -1.6141    0.1153 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0862   -1.6424    0.2915 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2506   -0.5212    0.0620 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9212    0.6040   -0.3573 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3144    0.6325   -0.5403 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0328   -0.6179    0.2515 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2285   -0.0876    0.2432 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5674    1.2029   -0.0992 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8807    1.6833   -0.0779 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8999    0.8483    0.2987 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5953   -0.4477    0.6470 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3131   -0.9225    0.6280 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2992    0.4553   -0.9865 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7957    1.5114   -1.1130 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0588   -1.4111   -0.2749 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0500   -2.5053    0.3027 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5990   -2.5303    0.6171 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4403    1.5279   -0.5724 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8056    1.5341   -0.8704 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7725    1.8701   -0.3977 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0869    2.7167   -0.3602 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9309    1.1797    0.3291 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4260   -1.0878    0.9419 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0787   -1.9458    0.9038 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