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
    3.1522   -0.4733    0.2634 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8986   -0.8430    0.4032 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8249    0.0294    0.0046 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0378    1.2770   -0.5359 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0284    2.0713   -0.9003 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2932    1.5943   -0.7137 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5169    0.3194   -0.1616 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4915   -0.4621    0.1966 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3717   -1.5383    0.6510 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4984   -0.6795    0.2574 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9727   -1.1461    0.5707 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4976    0.4571   -0.1363 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7093   -1.8331    0.8316 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0324    1.6709   -0.6908 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0796    3.0585   -1.3289 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1744    2.1956   -0.9908 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3665   -1.7461    1.7444 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1869   -2.4494    0.0378 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1932   -0.3427    1.0587 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0840   -1.1598   -0.5612 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