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
    2.8453   -1.2524   -0.1794 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5037    0.0062   -0.0607 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1374    0.5082    0.0168 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9477    1.8662    0.1406 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3398    2.3429    0.2140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4130    1.4812    0.1646 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2636    0.1037    0.0400 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0372   -0.3464   -0.0313 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4288   -0.7750   -0.0086 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3422   -2.0653   -0.1241 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1059   -2.0180   -0.2284 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8929   -1.5118   -0.2279 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3037    0.7449   -0.0156 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8072    2.5585    0.1804 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5403    3.4043    0.3120 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4428    1.8402    0.2213 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2130   -1.3857   -0.1268 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4123   -0.2737    0.0594 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3868   -2.5409   -0.1892 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2242   -2.6872   -0.1571 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