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
   -4.9932   -0.3712    0.3466 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1393   -0.0475   -0.5912 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7747    0.3237   -0.2785 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2542    0.3724    0.9881 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9214    0.7428    1.1968 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1015    1.0667    0.1389 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6009    1.0255   -1.1455 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9158    0.6572   -1.3155 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2137    1.4355    0.3045 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2400    0.4810    0.2988 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5473    0.8871    0.4678 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5316   -0.0814    0.4566 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2261   -1.4210    0.2818 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9175   -1.8209    0.1133 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9223   -0.8523    0.1236 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0209   -0.6503    0.1056 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7544   -0.3863    1.3944 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4645   -0.0593   -1.6176 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8738    0.1231    1.8442 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5194    0.7779    2.2063 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0362    1.2805   -2.0089 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3087    0.6246   -2.3237 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7870    1.9414    0.6053 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5742    0.1891    0.5856 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0194   -2.1573    0.2776 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7159   -2.8689   -0.0198 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9114   -1.2122   -0.0121 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