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
    0.3655   -1.3085    1.9799 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1698   -0.5763    0.9010 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3155   -0.0135    0.2051 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2586    1.1388   -0.5284 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3668    1.6462   -1.2124 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5689    0.9815   -1.1606 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6486   -0.1711   -0.4333 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5286   -0.6686    0.2473 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2201   -0.3620    0.4549 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5038   -0.1027   -0.8621 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8207    0.1246   -1.2742 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8699    0.0962   -0.3836 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5944   -0.1640    0.9402 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2834   -0.3861    1.3288 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3582   -1.4887    2.3441 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4467   -1.7510    2.5298 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3415    1.6922   -0.5769 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3113    2.5547   -1.7880 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4574    1.3299   -1.6707 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5635   -0.7326   -0.3573 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6304   -1.5794    0.8047 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7214   -0.0880   -1.5867 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0284    0.3291   -2.3208 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9004    0.2723   -0.6958 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4200   -0.1858    1.6359 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0756   -0.5869    2.3722 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