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
    3.6682   -0.1678    0.1224 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6753   -0.9986    0.2779 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2880   -0.6097    0.1218 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8978    0.6644   -0.2029 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4496    1.0068   -0.3459 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4292    0.0857   -0.1679 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0230   -1.2117    0.1630 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2855   -1.5681    0.3077 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8607    0.3420   -0.2940 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3101    1.5298   -0.6007 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7091   -0.4582    0.2392 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4759    0.8578   -0.1332 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9303   -2.0385    0.5398 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6184    1.4694   -0.3645 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7193    2.0237   -0.6032 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7755   -1.9896    0.3167 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6139   -2.5700    0.5640 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5861   -0.4526   -0.1350 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6478    2.3523   -0.7693 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3612    1.7330   -0.6969 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