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
   -0.2719   -2.2827   -0.8493 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1274   -1.0221   -0.5048 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2330   -0.4614   -0.4539 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2132   -0.9997   -1.2646 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4938   -0.4913   -1.1937 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8353    0.5275   -0.3513 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8790    1.0840    0.4691 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5941    0.5644    0.3897 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3137   -0.2058   -0.1766 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4700   -0.7888    0.2755 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6222   -0.0591    0.5695 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6089    1.3100    0.4019 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4643    1.9323   -0.0513 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3409    1.1632   -0.3315 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5808   -2.8808   -1.0846 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2588   -2.6992   -0.8928 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0247   -1.8174   -1.9732 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2857   -0.9095   -1.8328 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8664    0.9138   -0.3162 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1222    1.8992    1.1524 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8383    1.0008    1.0604 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5165   -1.8460    0.4202 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5266   -0.5512    0.9273 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4884    1.9171    0.6206 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4623    3.0106   -0.1805 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4947    1.6921   -0.6922 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