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
    3.5969    0.3974    0.6383 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3594    0.6683    0.9651 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1945    0.1611    0.2509 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2967   -0.6625   -0.8499 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1704   -1.1275   -1.5063 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1041   -0.7707   -1.0656 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2338    0.0473    0.0271 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0785    0.4945    0.6605 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5144    0.4758    0.5638 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6663    0.1207    0.0543 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8245   -0.2351   -0.2029 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4280    0.7957    1.1966 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1966    1.3227    1.8376 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2551   -0.9711   -1.2355 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2501   -1.7735   -2.3699 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9726   -1.1434   -1.5906 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1751    1.1377    1.5197 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5429    1.1291    1.4384 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5969    0.4539    0.4736 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6877   -0.5203   -0.8052 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