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
    1.3126   -0.4450   -1.9180 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5854   -0.1863   -0.8562 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1598    0.5610    0.2417 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1782    1.4771    0.0249 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7885    2.1958    1.0163 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3445    1.9780    2.3104 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3365    1.0746    2.5506 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7382    0.3630    1.5368 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7835   -0.6664   -0.8257 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7641   -0.0747   -0.0698 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0753   -0.5251   -0.0021 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3999   -1.6357   -0.7454 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4644   -2.2783   -1.5271 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1803   -1.7845   -1.5527 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3306   -0.0964   -1.9574 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9652   -0.9949   -2.7846 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5401    1.6639   -0.9935 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5811    2.9091    0.8498 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7871    2.5173    3.1466 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0166    0.9347    3.5952 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0414   -0.3471    1.8069 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5429    0.8226    0.5174 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7939   -0.0074    0.6167 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4198   -1.9913   -0.6968 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7374   -3.1660   -2.1174 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4617   -2.2979   -2.1668 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