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
    3.6475   -0.7362    0.0816 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8315    0.1939   -0.3877 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3968    0.0737   -0.3677 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7751   -1.0371    0.1505 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6253   -1.1340    0.1602 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3797   -0.0986   -0.3581 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7342    1.0038   -0.8717 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6387    1.1165   -0.8897 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8344   -0.1825   -0.3561 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6228    0.7569   -0.8292 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2242   -1.6278    0.4997 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7284   -0.5977    0.0435 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2584    1.1137   -0.8192 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3071   -1.8784    0.5695 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1301   -1.9813    0.5547 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2987    1.8500   -1.2939 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1217    1.9988   -1.3016 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3006   -1.0913    0.0692 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2955    1.6796   -1.2649 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7082    0.5780   -0.7717 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