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
   -0.0128    1.0917    2.1291 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0043    0.5099    0.9494 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2374    0.0600    0.3477 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4317    0.6627    0.6883 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6418    0.2488    0.1612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6716   -0.7972   -0.7336 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5042   -1.4221   -1.0966 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3040   -0.9818   -0.5478 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2460    0.3112    0.2454 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3394    0.2654   -1.1272 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5438    0.0462   -1.7542 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6836   -0.1311   -1.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5930   -0.0851    0.3728 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3844    0.1343    0.9952 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8942    1.4385    2.6022 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9151    1.2654    2.7140 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4131    1.4826    1.3854 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5841    0.7426    0.4454 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6330   -1.1270   -1.1537 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5028   -2.2600   -1.8097 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4087   -1.5124   -0.8465 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4671    0.4179   -1.7533 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6539    0.0032   -2.8400 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6472   -0.3055   -1.4593 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4650   -0.2192    1.0051 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3470    0.1611    2.0810 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