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
   -3.1341   -0.7721    0.2830 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8559   -1.0295    0.2531 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8239   -0.0275    0.0439 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1446    1.2935   -0.1406 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1069    2.2148   -0.3378 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1988    1.8259   -0.3492 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4844    0.4595   -0.1558 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5222   -0.4577    0.0366 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4966   -1.5423    0.1496 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5525   -0.5295   -0.0626 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8378   -1.5674    0.4428 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5292    0.2152    0.1535 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5424   -2.0755    0.3960 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1709    1.6346   -0.1371 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3824    3.2624   -0.4830 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0289    2.5365   -0.5029 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4311   -1.9810    1.1732 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4620   -2.3134   -0.6563 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1899   -0.4598    0.8723 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1618   -0.6867   -0.9788 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