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
    3.4679   -0.1980    0.3231 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2530   -0.6978    0.2955 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0461    0.0871    0.0755 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0881    1.4477   -0.1253 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1102    2.1461   -0.3316 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2983    1.4568   -0.3286 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3695    0.0831   -0.1283 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1852   -0.5812    0.0717 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6232   -0.6310   -0.1271 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7454   -1.9205    0.0560 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3316   -0.7965    0.4861 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5936    0.8547    0.1755 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1630   -1.7819    0.4508 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0159    1.9961   -0.1292 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0560    3.2133   -0.4873 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2123    1.9911   -0.4862 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1637   -1.6478    0.2337 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5292   -0.0434   -0.2919 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7397   -2.3909    0.0426 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9263   -2.5871    0.2253 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