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
    3.0214   -1.3834    0.5579 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6761   -0.1541    0.2806 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3355    0.2969    0.0658 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0662    1.6409   -0.2265 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1879    2.1094   -0.4368 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2543    1.2278   -0.3611 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0570   -0.1022   -0.0783 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2591   -0.5481    0.1333 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1336   -1.0822    0.0159 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3885   -0.7519   -0.1682 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0338   -1.7048    0.7163 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2713   -2.1476    0.6405 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5067    0.5689    0.2138 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9114    2.3208   -0.2828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4404    3.1382   -0.6649 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2661    1.5699   -0.5236 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3820   -1.6095    0.3558 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8829   -2.1388    0.2505 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1727   -1.4933   -0.0940 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6801    0.2432   -0.3943 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