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
    0.2441   -1.3540   -1.9775 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1206   -0.6018   -0.8996 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2498   -0.2554   -0.0587 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5285   -0.2360   -0.6230 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6256    0.0605    0.1530 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5205    0.3477    1.4994 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2651    0.3313    2.0666 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1527    0.0314    1.2849 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1985   -0.1056   -0.5412 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3596    1.0770    0.1338 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6329    1.4846    0.4731 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7564    0.7566    0.1638 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5414   -0.4247   -0.5161 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2953   -0.8673   -0.8721 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2144   -1.7625   -2.2996 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5879   -1.6152   -2.6123 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6270   -0.4579   -1.6809 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6088    0.0657   -0.3242 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4197    0.5767    2.0711 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1948    0.5578    3.1217 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2110    0.0184    1.7902 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4864    1.7049    0.3878 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7663    2.4323    1.0152 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7599    1.0801    0.4325 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4072   -1.0231   -0.7758 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1908   -1.8218   -1.4122 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