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
   -3.9861   -2.5653    0.7734 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8713   -1.7426   -0.2348 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6708   -0.9811   -0.4715 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6438   -0.1233   -1.5818 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5206    0.6252   -1.8506 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4009    0.5733   -1.0696 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4070   -0.2631    0.0256 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5449   -1.0336    0.3140 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7327    1.3228   -1.3332 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8453    1.2501   -0.5293 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0372    2.0747    0.5698 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1677    1.9713    1.3529 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1563    1.0427    1.0761 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9721    0.2188   -0.0160 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8377    0.3299   -0.7933 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1815   -2.6984    1.4605 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9012   -3.1154    0.9138 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7161   -1.6339   -0.9156 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5268   -0.0622   -2.2240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4911    1.2978   -2.7156 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4772   -0.3148    0.6563 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5240   -1.6831    1.1809 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2823    2.8122    0.8138 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3370    2.6070    2.2171 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0513    0.9567    1.6914 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7396   -0.5207   -0.2521 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7498   -0.3451   -1.6377 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