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
   -4.8811    1.0286   -0.4527 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1789    0.2680    0.3410 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8169   -0.1464    0.0670 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1282    0.2239   -1.0628 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8087   -0.1882   -1.3101 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1666   -0.9926   -0.3985 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8365   -1.3756    0.7394 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1263   -0.9624    0.9634 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1316   -1.3815   -0.6702 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2331   -0.6290   -0.2535 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9698    0.5386    0.4524 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0129    1.3192    0.8876 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3045    0.9330    0.6178 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5952   -0.2244   -0.0829 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5195   -0.9883   -0.5072 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4655    1.3916   -1.3729 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9142    1.3315   -0.2251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6520   -0.0693    1.2590 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6124    0.8569   -1.7954 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3601    0.1609   -2.2303 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3404   -2.0197    1.4824 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6650   -1.2530    1.8486 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9449    0.8229    0.6533 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8042    2.2351    1.4415 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1105    1.5408    0.9568 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6175   -0.5128   -0.2861 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7090   -1.9079   -1.0626 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