Monomers

1,3-Divinylbenzene

Identifiers

IUPAC name
1,3-bis(ethenyl)benzene
InchI
InChI=1S/C10H10/c1-3-9-6-5-7-10(4-2)8-9/h3-8H,1-2H2
InchI Key
PRJNEUBECVAVAG-UHFFFAOYSA-N
SMILES
C=Cc1cccc(c1)C=C
Canonical SMILES
C=CC1=CC(=CC=C1)C=C
Isomeric SMILES
C=CC1=CC(=CC=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
    3.5941    0.1058   -0.6031 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4224   -0.3329   -0.9923 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1878   -0.0075   -0.2609 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2174    0.7773    0.8701 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0417    1.0739    1.5473 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1585    0.5626    1.0591 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2052   -0.2246   -0.0717 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0207   -0.4987   -0.7183 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4649   -0.7623   -0.5856 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6389   -0.5545   -0.0377 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4737   -0.1726   -1.1917 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7806    0.7183    0.2452 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3600   -0.9448   -1.8659 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1362    1.1923    1.2779 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0670    1.6955    2.4427 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0680    0.8082    1.6066 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0135   -1.1119   -1.6083 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4123   -1.3669   -1.4726 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5302   -1.0024   -0.4990 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7686    0.0451    0.8583 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
  7  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
  6 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