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
   -3.3810   -0.7147   -0.2374 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1243   -1.0612   -0.3348 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0621   -0.1043   -0.0383 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2598    1.1865    0.3515 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2059    2.0681    0.6251 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0708    1.5934    0.4893 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3441    0.2873    0.0954 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2688   -0.5258   -0.1576 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7045   -0.1793   -0.0374 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9806   -1.3816   -0.3999 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6602    0.2671    0.0584 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1492   -1.4335   -0.4600 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8828   -2.0791   -0.6418 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2550    1.5672    0.4605 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4105    3.0934    0.9344 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8876    2.2485    0.6929 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3788   -1.5615   -0.4706 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5130    0.5242    0.1808 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2315   -2.1019   -0.6228 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0111   -1.6927   -0.4876 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