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
    3.7276    0.5736   -0.0863 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7782    0.2107    0.7293 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3691    0.1064    0.3674 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8966    0.3887   -0.9040 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4211    0.2932   -1.2497 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3793   -0.1046   -0.3111 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9382   -0.3896    0.9534 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4123   -0.2835    1.2782 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7644   -0.2105   -0.6541 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7108   -0.5737    0.1645 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7549    0.6237    0.2714 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5876    0.8384   -1.1187 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0297   -0.0388    1.7646 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6418    0.6987   -1.6364 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7929    0.5112   -2.2352 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6145   -0.7084    1.7539 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7191   -0.5143    2.2757 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0585    0.0329   -1.6901 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7687   -0.6342   -0.1716 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4683   -0.8201    1.1842 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