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
    3.6297    0.3874   -0.3282 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4403    0.9017   -0.3979 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2168    0.1663   -0.1148 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2588   -1.1572    0.2541 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0411   -1.7883    0.5075 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1726   -1.1347    0.4002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2200    0.1920    0.0307 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0131    0.8105   -0.2185 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4888    0.9229   -0.0949 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6631    0.3850    0.1295 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5097    0.9866   -0.5516 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8408   -0.6413   -0.0529 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3578    1.9616   -0.6901 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1933   -1.7015    0.3483 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0875   -2.8163    0.7932 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1105   -1.6467    0.6026 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0380    1.8626   -0.5123 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4708    1.9622   -0.3877 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5507    0.9868    0.0162 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8481   -0.6397    0.4286 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