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
    0.2541   -2.3176   -0.3632 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1093   -1.0155   -0.2501 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2986   -0.1761   -0.1669 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3165    1.0635    0.4506 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4800    1.8246    0.4706 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6427    1.3916   -0.1085 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6381    0.1748   -0.7180 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4809   -0.5829   -0.7388 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2580   -0.4897   -0.2074 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5410    0.7819   -0.6497 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8193    1.2797   -0.5817 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8221    0.4895   -0.0644 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5986   -0.7900    0.3925 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2877   -1.2499    0.3035 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2397   -2.7648   -0.3934 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5938   -2.9518   -0.4320 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4418    1.4395    0.9283 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4449    2.7780    0.9601 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5671    1.9623   -0.1096 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5352   -0.2020   -1.1860 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5489   -1.5302   -1.2414 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7181    1.3870   -1.0749 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0180    2.2870   -0.9366 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8402    0.8898   -0.0119 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3988   -1.4033    0.7982 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1024   -2.2757    0.6746 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