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
   -2.6182   -1.9042   -0.1614 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3467   -1.6725   -0.2785 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7682   -0.3849    0.0013 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5037    0.6962    0.4114 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8843    1.9279    0.6696 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4715    2.1132    0.5273 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2144    1.0271    0.1147 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6079   -0.1768   -0.1375 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9073   -0.8163   -0.5041 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5757    0.4940   -0.2308 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2956   -1.1412    0.1507 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0398   -2.8756   -0.3746 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7006   -2.4801   -0.5987 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5748    0.6358    0.5481 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4942    2.7759    0.9961 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9383    3.0840    0.7339 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2084   -1.6468    0.1929 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9759   -1.1097   -1.5868 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2767    0.4717    0.6233 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0501    0.9824   -1.0967 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