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
   -2.9941   -1.1075    1.0013 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6100    0.0772    0.5942 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2472    0.4026    0.2098 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9921    1.7176   -0.2047 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2851    2.0510   -0.5727 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2913    1.0874   -0.5275 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0352   -0.2015   -0.1199 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2677   -0.5543    0.2589 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0387   -1.2442   -0.0525 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2861   -1.0141   -0.3856 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0349   -1.2880    1.2762 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3337   -1.9599    1.0912 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3941    0.8494    0.5530 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7922    2.4453   -0.2301 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5533    3.0638   -0.9075 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2945    1.3650   -0.8208 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4681   -1.5775    0.5819 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7201   -2.2413    0.2888 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0312   -1.8166   -0.3279 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5986   -0.0547   -0.7154 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