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
    2.0647    0.1391    0.8398 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6722   -1.0549    0.4408 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5850   -0.9000   -0.5246 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4274    0.5725   -0.8284 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2950    1.2255    0.1960 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0397    0.8770   -0.6356 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3542    0.8492    0.8181 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0678   -0.3830    1.2121 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7812   -1.2433    0.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6455   -0.4891   -1.0143 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8808    0.3038    1.5756 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1041   -2.0227    0.7869 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7252   -1.4982   -1.4508 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7308    0.8251   -1.8602 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7020    1.7722    0.9638 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0211    1.9399   -0.2884 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4340    1.6955   -1.1918 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7317    1.6873    1.3730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0396   -0.7345    2.2289 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0188   -2.2730    0.1180 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3943   -0.7715   -2.0323 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7015   -0.5169   -0.7468 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