Monomers

Dicyclopentadiene

Identifiers

IUPAC name
tricyclo[5.2.1.02,6]deca-3,8-diene
InchI
InChI=1S/C10H12/c1-2-9-7-4-5-8(6-7)10(9)3-1/h1-2,4-5,7-10H,3,6H2
InchI Key
HECLRDQVFMWTQS-UHFFFAOYSA-N
SMILES
C1=CC2C(C1)C1C=CC2C1
Canonical SMILES
C1C=CC2C1C3CC2C=C3
Isomeric SMILES
C1C=CC2C1C3CC2C=C3
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C10H12
Heavy Atom Count
10
Molecular Weight
132.206
Exact Molecular Weight
132.0939
Valence Electrons
52
Radical Electrons
0
tPSA
0.0
MolLogP
2.3846
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
3
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
3
Aromatic Rings
0

MOL File


     RDKit          3D

 22 24  0  0  0  0  0  0  0  0999 V2000
   -2.0301    0.5744   -0.6553 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3436    1.2125    0.2665 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4016    0.3811    1.0269 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4948   -0.9576    0.3149 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6227   -0.8489   -0.6406 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8657   -1.0615   -0.3402 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0799    0.0688   -1.2762 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1992    1.1870   -0.5760 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0324    0.8165    0.8679 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7254   -0.5581    0.8399 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7915    0.9753   -1.3502 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4731    2.2937    0.4476 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7100    0.3091    2.0859 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5792   -1.7571    1.0563 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3417   -1.1562   -1.6882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4820   -1.5179   -0.3447 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1459   -2.0315   -0.6900 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1282   -0.0198   -2.3447 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3797    2.2029   -0.8883 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4221    1.4997    1.5763 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7768   -0.4770    0.5637 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5151   -1.1354    1.7483 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  4  6  1  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  1  0
  5  1  1  0
 10  6  1  0
  9  3  1  0
  1 11  1  0
  2 12  1  0
  3 13  1  0
  4 14  1  0
  5 15  1  0
  5 16  1  0
  6 17  1  0
  7 18  1  0
  8 19  1  0
  9 20  1  0
 10 21  1  0
 10 22  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers