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
    2.4997   -1.1747    1.2835 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2190    0.0756    1.0812 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9970    0.5179    0.4605 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8298    1.8966    0.3067 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3277    2.3318   -0.2820 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2895    1.4590   -0.7068 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1015    0.0871   -0.5432 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0450   -0.3906    0.0424 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1398   -0.7995   -1.0046 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0524   -2.0941   -0.8942 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8462   -1.9819    1.0060 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4544   -1.4855    1.7667 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9757    0.8108    1.4130 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6003    2.5928    0.6472 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4477    3.4205   -0.3975 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1884    1.8432   -1.1664 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2206   -1.4552    0.1838 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0425   -0.3678   -1.4685 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2009   -2.5859   -0.4521 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8974   -2.7001   -1.2757 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