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
   -0.2199    1.7110    1.4581 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1061    0.7397    0.5715 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3208    0.2078   -0.0565 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3761   -1.0688   -0.5578 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5409   -1.4958   -1.1574 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6620   -0.7098   -1.2832 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5982    0.5705   -0.7764 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4388    0.9986   -0.1789 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2191    0.2403    0.2623 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2464    0.3061    1.2057 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5232   -0.1284    0.9462 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8597   -0.6607   -0.2804 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8623   -0.7330   -1.2203 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5813   -0.2971   -0.9614 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1751    2.1321    1.7421 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6422    2.1421    1.9479 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5185   -1.7617   -0.4766 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5779   -2.5163   -1.5562 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5748   -1.0731   -1.7639 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4762    1.2182   -0.8624 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4670    2.0299    0.1968 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0324    0.7137    2.1881 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3238   -0.0747    1.6875 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8709   -1.0044   -0.4835 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0926   -1.1423   -2.1843 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7981   -0.3438   -1.7273 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