Monomers

alpha-Pinene

Identifiers

IUPAC name
2,6,6-trimethylbicyclo[3.1.1]hept-2-ene
InchI
InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H3
InchI Key
GRWFGVWFFZKLTI-UHFFFAOYSA-N
SMILES
CC1=CCC2CC1C2(C)C
Canonical SMILES
CC1=CCC2CC1C2(C)C
Isomeric SMILES
CC1=CCC2CC1C2(C)C
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C10H16
Heavy Atom Count
10
Molecular Weight
136.238
Exact Molecular Weight
136.1252
Valence Electrons
56
Radical Electrons
0
tPSA
0.0
MolLogP
2.9987
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

 26 27  0  0  0  0  0  0  0  0999 V2000
    2.5775   -1.1048   -0.2261 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4435   -0.1410   -0.0955 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5320    0.7974    0.8417 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2239    1.4194    1.2613 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8234    1.1815    0.2267 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1861    1.2831   -1.1648 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2420   -0.1748   -0.9432 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0146   -0.2853   -0.0916 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8931   -1.2279    1.0551 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2658   -0.4870   -0.8888 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2844   -2.0170   -0.7432 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9719   -1.3769    0.7877 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3730   -0.5750   -0.7946 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4710    1.1111    1.2890 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3758    2.4887    1.3910 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0611    0.9359    2.2166 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7284    1.7702    0.3615 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6303    1.9968   -1.2456 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9790    1.3183   -1.9188 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2628   -0.7848   -1.8390 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0378   -1.0439    1.7065 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8634   -1.2675    1.5789 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7359   -2.2580    0.6200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7409    0.4819   -1.1965 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0552   -1.0464   -0.3380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0037   -0.9939   -1.8505 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  8 10  1  0
  7  2  1  0
  8  5  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  3 14  1  0
  4 15  1  0
  4 16  1  0
  5 17  1  0
  6 18  1  0
  6 19  1  0
  7 20  1  0
  9 21  1  0
  9 22  1  0
  9 23  1  0
 10 24  1  0
 10 25  1  0
 10 26  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers