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
    5.0666    0.4434    0.3436 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2293    0.1085   -0.6042 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8489   -0.2633   -0.3759 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3102   -0.2907    0.8827 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9788   -0.6524    1.0720 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1480   -0.9950    0.0290 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7131   -0.9606   -1.2346 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0187   -0.6086   -1.4478 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1781   -1.3575    0.1958 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2393   -0.4933    0.1831 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7226    0.1287    1.3131 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7974    0.9856    1.2084 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4347    1.2663    0.0155 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9363    0.6339   -1.1044 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8626   -0.2252   -1.0150 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0900    0.7099    0.0837 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8341    0.4826    1.3947 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5858    0.1068   -1.6346 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9225   -0.0314    1.7190 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5686   -0.6684    2.0794 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0554   -1.2317   -2.0594 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4444   -0.5880   -2.4530 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2587   -0.0553    2.2820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1927    1.4887    2.1043 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2844    1.9504   -0.0340 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4033    0.8188   -2.0817 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5044   -0.7022   -1.9319 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