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
    3.0807   -1.0769    1.5968 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8310   -1.3088    1.2912 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9902   -0.3897    0.5355 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4833    0.8195    0.0844 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6594    1.6537   -0.6221 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6383    1.2813   -0.8722 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1511    0.0938   -0.4388 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3029   -0.7355    0.2734 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4997   -0.3766   -0.6560 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3747    0.3242   -1.3117 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6802   -1.7868    2.1635 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6079   -0.1779    1.3159 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4128   -2.2661    1.6389 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5028    1.1289    0.2723 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9991    2.6169   -0.9995 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3056    1.9469   -1.4392 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6624   -1.7061    0.6479 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8015   -1.3308   -0.2703 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3982    0.0082   -1.4975 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1131    1.2815   -1.7126 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