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
   -5.0385    0.7675    0.2979 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2593   -0.2505    0.0423 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8517   -0.1420   -0.3189 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1100   -1.2858   -0.5711 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7652   -1.2135   -0.9178 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1208    0.0016   -1.0231 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8369    1.1515   -0.7773 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1782    1.0553   -0.4327 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2213    0.0251   -1.3716 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2507   -0.0192   -0.4509 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7928   -1.2121   -0.0314 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8178   -1.3002    0.8829 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3358   -0.1330    1.4127 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8187    1.0837    1.0169 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7912    1.1307    0.0980 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0651    0.6080    0.5572 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6496    1.7645    0.2480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6878   -1.2485    0.1025 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6169   -2.2489   -0.4886 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2378   -2.1499   -1.1035 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3276    2.1021   -0.8610 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7054    1.9748   -0.2479 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4053   -2.1354   -0.4306 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2526   -2.2309    1.2207 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1345   -0.1730    2.1267 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2282    1.9896    1.4348 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4018    2.0886   -0.1976 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