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
    5.1517   -0.6638    0.6241 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0007   -1.1701    0.2355 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7420   -0.4540    0.3347 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5737   -1.0480   -0.0929 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3454   -0.4318   -0.0302 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2717    0.8469    0.4862 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4194    1.4535    0.9158 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6646    0.8231    0.8499 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9535    1.4890    0.5600 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1135    0.8799    0.1273 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8546    0.1215    1.0319 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0228   -0.5165    0.6747 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4800   -0.4043   -0.6229 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7623    0.3382   -1.5246 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5789    0.9875   -1.1722 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2502    0.3224    1.0466 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0420   -1.2612    0.5164 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9864   -2.1777   -0.1827 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6141   -2.0627   -0.5056 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5791   -0.9102   -0.3720 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3735    2.4698    1.3282 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5175    1.3529    1.2017 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5183    0.0148    2.0635 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5782   -1.1060    1.4200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3889   -0.9031   -0.8930 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1034    0.4385   -2.5457 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0195    1.5712   -1.8909 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