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
    5.0801   -0.9649    0.6997 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5039   -0.0474   -0.0340 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0716    0.1642   -0.1391 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5911    1.1720   -0.9527 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2451    1.3828   -1.0619 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2809    0.6252   -0.3852 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7835   -0.3695    0.4175 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1552   -0.6038    0.5444 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0124    0.9454   -0.5849 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2083    0.4122   -0.3865 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4749   -0.9126   -0.1692 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7656   -1.4150    0.0386 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8279   -0.5672    0.0288 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6139    0.7649   -0.1848 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3437    1.2473   -0.3873 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1589   -1.0702    0.7339 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4934   -1.6327    1.2834 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1510    0.6147   -0.6160 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3223    1.7881   -1.5004 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8850    2.1714   -1.6993 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1253   -0.9980    0.9953 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5139   -1.3852    1.1759 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7040   -1.6581   -0.1621 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9369   -2.4557    0.2059 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8328   -0.9326    0.1870 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4780    1.4282   -0.1893 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1628    2.2963   -0.5569 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