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
    4.7038   -1.0296    0.9661 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9719    0.0423    1.0370 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7197    0.1713    0.3308 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9982    1.3664    0.4677 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7995    1.5426   -0.1827 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2861    0.5414   -0.9836 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9959   -0.6280   -1.1153 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2203   -0.8356   -0.4643 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9260    0.7406   -1.6312 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0736    0.3411   -0.9118 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5518   -0.9324   -1.0405 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6672   -1.3094   -0.3370 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3219   -0.4206    0.5056 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8185    0.8563    0.6164 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7022    1.2346   -0.0873 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4438   -1.8893    0.3893 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6569   -1.1111    1.5118 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3158    0.8634    1.6467 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3767    2.1736    1.0918 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2167    2.4577   -0.0965 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6245   -1.4453   -1.7399 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7371   -1.7799   -0.6052 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0610   -1.6596   -1.6957 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0859   -2.3266   -0.4117 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1899   -0.7679    1.0322 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3422    1.5446    1.2815 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3266    2.2593    0.0232 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