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
    3.6987   -0.0290    0.7012 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7090   -0.8245    0.3723 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3512   -0.3544    0.3547 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3580   -1.2700   -0.0080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9777   -0.9112   -0.0541 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3261    0.3787    0.2661 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3582    1.3091    0.6301 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9590    0.9220    0.6664 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7174    0.8151    0.2354 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6658   -0.0103   -0.0972 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7331   -0.3876    0.7145 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5252    0.9899    0.9652 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9271   -1.8545    0.1101 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6221   -2.2988   -0.2649 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7209   -1.6741   -0.3471 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6577    2.3371    0.8829 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7009    1.6700    0.9551 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9407    1.8591    0.5008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5279   -1.0234   -0.3633 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6920    0.3570   -0.1072 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