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
   -0.0261   -2.1512    0.9961 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0329   -0.9780    0.4125 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2205   -0.3020    0.1637 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3827   -1.0402   -0.0282 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5902   -0.4171   -0.2365 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7154    0.9509   -0.2666 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5709    1.6868   -0.0773 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3539    1.0890    0.1329 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2836   -0.3801    0.0328 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3045    0.5095   -1.0114 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4870    1.1235   -1.3897 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6484    0.8455   -0.7222 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6381   -0.0528    0.3343 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4457   -0.6540    0.6953 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9086   -2.6433    1.3063 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9780   -2.6423    1.1711 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3275   -2.1195   -0.0153 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4574   -1.0684   -0.3789 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6864    1.4251   -0.4342 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6794    2.7707   -0.1028 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4653    1.7115    0.2979 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4218    0.7739   -1.6102 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4758    1.8189   -2.2132 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5505    1.3463   -1.0491 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5735   -0.2442    0.8332 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4924   -1.3585    1.5430 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