Monomers

1-Octene

Identifiers

IUPAC name
oct-1-ene
InchI
InChI=1S/C8H16/c1-3-5-7-8-6-4-2/h3H,1,4-8H2,2H3
InchI Key
KWKAKUADMBZCLK-UHFFFAOYSA-N
SMILES
CCCCCCC=C
Canonical SMILES
CCCCCCC=C
Isomeric SMILES
CCCCCCC=C
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H16
Heavy Atom Count
8
Molecular Weight
112.216
Exact Molecular Weight
112.1252
Valence Electrons
48
Radical Electrons
0
tPSA
0.0
MolLogP
3.1428
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 24 23  0  0  0  0  0  0  0  0999 V2000
   -2.1551    1.6454   -0.1997 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4646    0.1924   -0.0508 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2416   -0.6501    0.2081 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2394   -0.5270   -0.9412 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9767   -1.3621   -0.6955 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7692   -1.0323    0.5128 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4140    0.2616    0.5892 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5436    1.1305   -0.3861 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5298    1.8820   -1.0755 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1155    2.1821   -0.3441 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7125    2.0157    0.7475 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0064   -0.2142   -0.9253 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1278    0.0730    0.8306 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7952   -0.3614    1.1642 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5370   -1.7159    0.2663 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0059    0.5417   -0.9887 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7039   -0.8703   -1.8905 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5957   -2.4214   -0.5648 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6167   -1.4477   -1.6191 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0643   -1.1298    1.3986 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5651   -1.8300    0.6736 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8440    0.5565    1.5667 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1826    0.9896   -1.3867 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0510    2.0914   -0.2237 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  3
  1  9  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  2 13  1  0
  3 14  1  0
  3 15  1  0
  4 16  1  0
  4 17  1  0
  5 18  1  0
  5 19  1  0
  6 20  1  0
  6 21  1  0
  7 22  1  0
  8 23  1  0
  8 24  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers