Monomers

1,1-Diphenylethylene

Identifiers

IUPAC name
1-phenylethenylbenzene
InchI
InChI=1S/C14H12/c1-12(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11H,1H2
InchI Key
ZMYIIHDQURVDRB-UHFFFAOYSA-N
SMILES
C=C(c1ccccc1)c1ccccc1
Canonical SMILES
C=C(C1=CC=CC=C1)C2=CC=CC=C2
Isomeric SMILES
C=C(C1=CC=CC=C1)C2=CC=CC=C2
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C14H12
Heavy Atom Count
14
Molecular Weight
180.25
Exact Molecular Weight
180.0939
Valence Electrons
68
Radical Electrons
0
tPSA
0.0
MolLogP
3.7481
H Bond Acceptors
0
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

 26 27  0  0  0  0  0  0  0  0999 V2000
    0.2797    1.8293   -1.5196 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1257    0.8352   -0.6766 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1733    0.5143   -0.1457 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1792    1.4782    0.0044 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4251    1.2149    0.4706 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7305   -0.0809    0.8219 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8065   -1.0800    0.7056 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5374   -0.7655    0.2213 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2892    0.0758   -0.2990 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3003   -0.5603    0.9185 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4334   -1.3055    1.2384 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5045   -1.4202    0.4042 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4962   -0.7897   -0.8034 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3830   -0.0465   -1.1402 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6001    2.3952   -1.7994 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2462    2.0981   -1.9378 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9208    2.4824   -0.2728 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2035    1.9550    0.5877 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7171   -0.3600    1.2051 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0296   -2.1100    0.9783 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8309   -1.6058    0.1255 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4908   -0.5017    1.6462 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4425   -1.8069    2.1962 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3995   -2.0095    0.6583 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3494   -0.8802   -1.4688 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4137    0.4445   -2.1189 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
  2  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
  8  3  1  0
 14  9  1  0
  1 15  1  0
  1 16  1  0
  4 17  1  0
  5 18  1  0
  6 19  1  0
  7 20  1  0
  8 21  1  0
 10 22  1  0
 11 23  1  0
 12 24  1  0
 13 25  1  0
 14 26  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers