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
    3.5597   -0.7594   -0.2137 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3325   -1.0080   -0.5699 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1760   -0.2677   -0.0701 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3100    0.7648    0.8305 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1516    1.4022    1.2418 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1052    1.0522    0.7953 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2105    0.0091   -0.1111 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0566   -0.6395   -0.5326 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5002   -0.4059   -0.6173 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6367    0.1386   -0.2831 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3841   -1.3577   -0.6305 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8157    0.0285    0.4915 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1787   -1.8257   -1.2887 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2832    1.0643    1.2007 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2075    2.2216    1.9507 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9933    1.5804    1.1445 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1693   -1.4673   -1.2552 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4902   -1.2462   -1.3364 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6789    0.9466    0.4046 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5580   -0.2307   -0.7071 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