Monomers

1,4-Divinylbenzene

Identifiers

IUPAC name
1,4-bis(ethenyl)benzene
InchI
InChI=1S/C10H10/c1-3-9-5-7-10(4-2)8-6-9/h3-8H,1-2H2
InchI Key
WEERVPDNCOGWJF-UHFFFAOYSA-N
SMILES
C=Cc1ccc(cc1)C=C
Canonical SMILES
C=CC1=CC=C(C=C1)C=C
Isomeric SMILES
C=CC1=CC=C(C=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
    3.6651    0.5164   -0.1993 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8214   -0.4822   -0.1740 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3900   -0.3293   -0.1505 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6123   -1.4820   -0.1246 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7588   -1.4083   -0.1013 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4347   -0.1783   -0.1024 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6555    0.9275   -0.1279 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7384    0.8796   -0.1519 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8773   -0.2150   -0.0767 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5773    0.8949   -0.0760 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7368    0.3718   -0.2166 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2868    1.5232   -0.2031 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2520   -1.4899   -0.1711 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0842   -2.4731   -0.1223 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3426   -2.3256   -0.0812 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1009    1.9101   -0.1305 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3179    1.8132   -0.1720 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4169   -1.1508   -0.0574 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0744    1.8461   -0.0948 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6664    0.8519   -0.0564 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
  6  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
  7 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