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
    3.3503   -0.7908   -0.7053 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0889   -1.1106   -0.7109 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0697   -0.1388   -0.3048 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3664    1.1364    0.0970 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3477    2.0180    0.4729 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9543    1.5834    0.4323 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3072    0.3071    0.0346 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2802   -0.5254   -0.3256 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6997   -0.0879    0.0144 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1657   -1.2667   -0.3417 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0766   -1.5581   -1.0196 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7640    0.1378   -0.4286 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7504   -2.1010   -1.0143 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3888    1.4850    0.1314 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6010    3.0228    0.7880 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7153    2.3090    0.7355 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5284   -1.5445   -0.6459 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4531    0.6525    0.3218 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4691   -2.0307   -0.6525 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2305   -1.4975   -0.3334 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