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
   -2.6734    1.4867   -0.3262 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4960    0.1953   -0.2415 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1807   -0.4101   -0.0877 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0323   -1.7884   -0.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1935   -2.3867    0.1441 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3339   -1.6298    0.2097 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2105   -0.2287    0.1242 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0334    0.3474   -0.0215 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4118    0.5781    0.1929 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4008    1.8689    0.1234 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9003    2.2277   -0.2937 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7140    1.8390   -0.4412 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3545   -0.4936   -0.2847 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9114   -2.4200   -0.0491 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3058   -3.4796    0.2123 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3074   -2.0634    0.3228 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1085    1.4335   -0.0858 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3738    0.0473    0.3102 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3405    2.4158    0.1816 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5264    2.4604    0.0110 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