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
    0.1674   -2.1064    1.1051 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0709   -0.9541    0.4890 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2656   -0.2611    0.0469 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4355   -0.9461   -0.2744 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5931   -0.3413   -0.6655 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6367    1.0316   -0.7575 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4948    1.7453   -0.4463 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3301    1.1131   -0.0510 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2638   -0.3936    0.2681 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4815    0.4492   -0.7941 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7220    0.9952   -0.9885 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7380    0.6952   -0.1208 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5851   -0.1421    0.9616 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3128   -0.6702    1.1180 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1482   -2.5248    1.2756 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7173   -2.6407    1.4397 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3981   -2.0231   -0.2057 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4923   -0.8911   -0.9110 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5588    1.5133   -1.0694 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5610    2.8201   -0.5283 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4876    1.7306    0.1908 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6661    0.6804   -1.5085 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8960    1.6642   -1.8300 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7001    1.1612   -0.3301 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4031   -0.3613    1.6289 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1545   -1.3435    1.9783 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