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
    3.1320   -0.2763    0.5054 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9290   -0.7538    0.3726 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8077    0.1018    0.0352 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9173    1.4550   -0.1682 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1770    2.2312   -0.4878 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3916    1.6061   -0.5980 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5289    0.2166   -0.3935 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4526   -0.5245   -0.0828 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2241   -1.7608   -0.0147 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4063   -0.9446   -0.3563 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3201    0.7644    0.3676 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9723   -0.9401    0.7620 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7769   -1.8120    0.5197 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8811    1.9318   -0.0777 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0676    3.3183   -0.6475 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2644    2.1570   -0.8417 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8904   -2.5124   -0.7676 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2815   -2.1971    1.0294 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8806   -1.2201   -1.3455 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1713   -0.8403    0.4521 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