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
    3.6664    0.1397   -0.1559 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4961    0.3506   -0.6949 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2181    0.0519   -0.0620 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1220   -0.4957    1.1987 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1137   -0.7542    1.7405 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2886   -0.4714    1.0351 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2181    0.0738   -0.2212 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0387    0.3168   -0.7264 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3753    0.3999   -1.0258 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6201    0.2116   -0.6465 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5852    0.3944   -0.7035 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7887   -0.2820    0.8236 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4778    0.7882   -1.7063 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0478   -0.7083    1.7309 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1712   -1.1784    2.7179 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2528   -0.6834    1.4818 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1117    0.7526   -1.7297 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2358    0.8350   -2.0246 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4622    0.4715   -1.2842 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8147   -0.2127    0.3248 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