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
   -3.0378   -0.4486   -1.3179 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6789    0.1597   -0.2388 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3001    0.2659    0.1973 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0293    0.9539    1.3924 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2576    1.0749    1.8360 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2874    0.5184    1.1045 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0590   -0.1567   -0.0613 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2507   -0.2748   -0.5042 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1047   -0.7586   -0.8654 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3765   -0.7095   -0.5442 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3420   -0.9204   -1.9716 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0852   -0.5017   -1.6033 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4572    0.6220    0.3837 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8665    1.3850    1.9517 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4343    1.6154    2.7682 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2781    0.6368    1.4879 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4778   -0.8026   -1.4246 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8763   -1.2941   -1.7990 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6976   -0.2062    0.3533 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1541   -1.1587   -1.1450 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