Monomers

1,3-Divinylbenzene

Identifiers

IUPAC name
1,3-bis(ethenyl)benzene
InchI
InChI=1S/C10H10/c1-3-9-6-5-7-10(4-2)8-9/h3-8H,1-2H2
InchI Key
PRJNEUBECVAVAG-UHFFFAOYSA-N
SMILES
C=Cc1cccc(c1)C=C
Canonical SMILES
C=CC1=CC(=CC=C1)C=C
Isomeric SMILES
C=CC1=CC(=CC=C1)C=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C10H10
Heavy Atom Count
10
Molecular Weight
130.19
Exact Molecular Weight
130.0783
Valence Electrons
50
Radical Electrons
0
tPSA
0.0
MolLogP
2.9726
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
1

MOL File


     RDKit          3D

 20 20  0  0  0  0  0  0  0  0999 V2000
   -3.5869    0.5824   -0.3383 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3873    1.0909   -0.2442 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2023    0.2665   -0.2790 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2900   -1.0894   -0.4126 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1088   -1.8438   -0.4408 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1116   -1.2306   -0.3362 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2404    0.1332   -0.2003 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0636    0.8420   -0.1763 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5294    0.8058   -0.0873 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6698    0.1664   -0.1061 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8199   -0.4683   -0.4482 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4516    1.2731   -0.3043 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2799    2.1783   -0.1355 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2375   -1.6051   -0.4977 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2324   -2.9083   -0.5478 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9945   -1.8487   -0.3625 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1074    1.9362   -0.0694 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5086    1.9006    0.0172 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5947    0.7208   -0.0182 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7765   -0.9019   -0.2049 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
  7  9  1  0
  9 10  2  3
  8  3  1  0
  1 11  1  0
  1 12  1  0
  2 13  1  0
  4 14  1  0
  5 15  1  0
  6 16  1  0
  8 17  1  0
  9 18  1  0
 10 19  1  0
 10 20  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers