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
   -3.6649   -0.4045   -0.1612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6326    0.3238    0.1621 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2305   -0.0883   -0.0064 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8570   -1.3045   -0.5312 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4706   -1.6934   -0.6901 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4431   -0.7970   -0.2942 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1348    0.4367    0.2387 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2098    0.7626    0.3702 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1654    1.3754    0.6536 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4489    1.1319    0.5582 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6570   -0.0301   -0.0061 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5259   -1.3784   -0.5826 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8098    1.3173    0.5916 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6362   -2.0009   -0.8390 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -2.6741   -1.1137 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4602   -1.1313   -0.4317 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4509    1.7397    0.7923 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8416    2.3428    1.0702 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8231    0.2072    0.1604 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1725    1.8652    0.8816 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