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
    0.0484   -0.4373   -2.3313 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0051   -0.1826   -1.0353 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2730    0.0484   -0.3437 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3577    0.5762   -1.0276 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5813    0.7827   -0.4196 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7666    0.4667    0.9049 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6916   -0.0564    1.5817 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4644   -0.2669    0.9827 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2953   -0.1439   -0.3352 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4788    0.5843    0.8186 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7151    0.5818    1.4748 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7875   -0.1391    1.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6098   -0.8679   -0.1525 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3777   -0.8613   -0.7996 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9960   -0.4697   -2.8405 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8703   -0.6152   -2.9050 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2843    0.8586   -2.0907 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4244    1.1943   -0.9569 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7278    0.6210    1.4113 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7963   -0.3188    2.6281 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6381   -0.6985    1.5448 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6603    1.1835    1.2211 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8276    1.1622    2.3775 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7317   -0.1232    1.5274 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4489   -1.4348   -0.5283 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2518   -1.4440   -1.7069 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