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
   -3.0225    1.4289   -0.7086 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6865    0.1721   -0.6528 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3252   -0.3066   -0.5108 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0584   -1.6597   -0.4600 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2114   -2.1282   -0.3272 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2564   -1.2155   -0.2417 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0506    0.1392   -0.2866 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2749    0.5716   -0.4241 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1338    1.0965   -0.1981 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3731    0.7445   -0.0706 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2909    2.2414   -0.6518 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0788    1.7070   -0.8170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4877   -0.5724   -0.7176 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8900   -2.3427   -0.5289 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4479   -3.2000   -0.2845 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2588   -1.6405   -0.1359 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3960    1.6382   -0.4555 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8969    2.1475   -0.2404 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2006    1.4589   -0.0027 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6812   -0.2803   -0.0219 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