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
    5.2344    0.5600    0.1879 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5312   -0.5294    0.0298 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0779   -0.5011    0.0025 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3531    0.6575    0.1390 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9521    0.6589    0.1092 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2516   -0.5087   -0.0589 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0276   -1.6762   -0.1955 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3760   -1.7032   -0.1703 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0424   -0.6029   -0.0990 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2320   -0.0806   -0.0558 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3351   -0.9576   -0.1946 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6316   -0.5123   -0.1638 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8947    0.8308    0.0069 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8615    1.7284    0.1470 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5573    1.2422    0.1110 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8392    1.5505    0.3095 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3367    0.5115    0.2050 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0541   -1.4692   -0.0824 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8659    1.6214    0.2764 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5044    1.6221    0.2260 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5034   -2.6173   -0.3302 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9872   -2.5912   -0.2737 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1789   -2.0190   -0.3307 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4854   -1.1785   -0.2696 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8997    1.2154    0.0360 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0244    2.8009    0.2843 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7518    1.9477    0.2209 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