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
    3.1486   -0.5959    0.3400 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8803   -0.8830    0.5027 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8208   -0.0171    0.0122 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1320    1.1427   -0.6448 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0857    1.9254   -1.0882 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2173    1.5623   -0.8825 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5268    0.3735   -0.2091 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5060   -0.4074    0.2333 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4691   -1.3842    0.7866 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5703   -0.5252    0.3000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8876   -1.2870    0.7315 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5180    0.2762   -0.1542 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6349   -1.8216    1.0345 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1255    1.5025   -0.8487 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2620    2.8695   -1.6230 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0126    2.1926   -1.2396 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4379   -1.4886    1.9005 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3634   -2.3480    0.2499 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1748   -1.0279   -0.4977 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2173   -0.0589    1.0965 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