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
    0.1376    2.1505   -1.1041 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0566    0.9398   -0.5433 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2942    0.2769   -0.1314 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4931    0.5510   -0.7567 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6882   -0.0543   -0.3522 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7145   -0.9517    0.6907 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5307   -1.2378    1.3264 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3472   -0.6284    0.9148 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2746    0.3382   -0.3648 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4618   -1.0267   -0.3125 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7231   -1.6005   -0.1162 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8364   -0.8061    0.0328 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6607    0.5580   -0.0185 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3965    1.1281   -0.2147 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0875    2.6109   -1.2411 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7520    2.6924   -1.4364 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5056    1.2514   -1.5867 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6066    0.1914   -0.8728 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6580   -1.3925    0.9662 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5621   -1.9448    2.1452 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4581   -0.8669    1.4445 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6097   -1.6674   -0.4424 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8454   -2.6734   -0.0781 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8051   -1.2638    0.1838 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4899    1.2135    0.0910 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2849    2.2121   -0.2472 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