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
    2.8504    1.0325   -1.8778 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6033    1.2207   -1.5612 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9140    0.4069   -0.5627 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5443   -0.6201    0.1133 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8659   -1.3752    1.0549 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4477   -1.1296    1.3459 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1223   -0.1148    0.6981 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4084    0.6230   -0.2418 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5179    0.2095    0.9504 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2205   -0.4522    1.8175 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5184    0.2883   -1.4702 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3283    1.6683   -2.6343 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0451    2.0042   -2.0468 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5788   -0.8400   -0.0921 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3737   -2.1900    1.5883 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9308   -1.7421    2.0836 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9229    1.4345   -0.7696 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9574    1.0282    0.3871 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8282   -1.2587    2.3882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2660   -0.1934    1.9923 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