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
   -0.2278   -2.2951   -0.4304 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1056   -1.0331   -0.1044 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2671   -0.1731   -0.0657 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5412   -0.6838    0.2145 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6720    0.1030    0.2296 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5706    1.4424   -0.0373 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3509    1.9753   -0.3142 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2161    1.1878   -0.3302 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2195   -0.5239    0.2137 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4037    0.5534    1.0464 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6501    1.0593    1.3338 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7507    0.4524    0.7583 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6175   -0.6287   -0.0809 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3563   -1.1025   -0.3423 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2056   -2.6814   -0.6692 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5680   -3.0164   -0.4869 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6165   -1.7591    0.4311 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6392   -0.3321    0.4512 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4356    2.0934   -0.0347 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1966    3.0376   -0.5365 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2346    1.6202   -0.5734 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5202    1.0133    1.5121 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7660    1.9218    2.0022 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7384    0.8367    0.9730 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4826   -1.1200   -0.5440 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2064   -1.9476   -0.9965 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