Monomers

2-Ethenylbicyclo[4.2.0]octa-1,3,5-triene

Identifiers

IUPAC name
2-ethenylbicyclo[4.2.0]octa-1(6),2,4-triene
InchI
InChI=1S/C10H10/c1-2-8-4-3-5-9-6-7-10(8)9/h2-5H,1,6-7H2
InchI Key
ZETZHGKAZZCCRL-UHFFFAOYSA-N
SMILES
C=Cc1cccc2c1CC2
Canonical SMILES
C=CC1=CC=CC2=C1CC2
Isomeric SMILES
C=CC1=CC=CC2=C1CC2
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
2.4282
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
1
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
1

MOL File


     RDKit          3D

 20 21  0  0  0  0  0  0  0  0999 V2000
    2.8163   -1.5027   -0.0663 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5372   -1.4854    0.1185 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7564   -0.2697   -0.0530 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3795    0.9044   -0.4217 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6528    2.0681   -0.5889 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7047    2.0151   -0.3762 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3409    0.8501   -0.0076 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6341   -0.3039    0.1602 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8204   -1.0997    0.5228 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6160    0.1616    0.3428 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3722   -2.4404    0.0728 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4150   -0.6698   -0.3512 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0100   -2.3831    0.4081 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4516    0.9989   -0.6021 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1482    3.0060   -0.8831 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2770    2.9449   -0.5110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0682   -1.9350   -0.1621 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7366   -1.4890    1.5501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9897    0.5154    1.3238 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3516    0.1143   -0.4761 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
  8  9  1  0
  9 10  1  0
  8  3  1  0
 10  7  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
  9 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