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
   -0.0886    0.9075   -2.0919 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0635    0.4051   -0.8679 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3052    0.0863   -0.1803 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4304    0.0950    1.1959 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6298   -0.2437    1.7852 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7395   -0.5993    1.0515 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6330   -0.6127   -0.3178 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4277   -0.2723   -0.8960 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2676    0.1979   -0.2657 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5002   -0.7306    0.7304 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7405   -0.9156    1.3191 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8091   -0.1501    0.9086 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6187    0.7865   -0.0828 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3563    0.9501   -0.6568 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7899    1.1650   -2.6580 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0418    1.0781   -2.5606 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5926    0.3834    1.8305 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7241   -0.2358    2.8794 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6680   -0.8592    1.5746 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5034   -0.8912   -0.8929 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3721   -0.2961   -1.9804 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6989   -1.3810    1.0889 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8792   -1.6678    2.1107 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8015   -0.2606    1.3424 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4777    1.3699   -0.3815 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2799    1.6914   -1.4136 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