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
   -3.9374    0.2415    0.3278 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7535   -0.5442   -0.1637 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4810    0.2279    0.1020 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2630   -0.5598   -0.3936 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9428    0.3003   -0.0790 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2272   -0.3512   -0.5137 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3416    0.5660   -0.1630 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3116    0.1975    0.6617 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9497    0.1365    1.4476 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8042    1.3133    0.0781 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8835   -0.1755   -0.0261 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7196   -1.5109    0.3589 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8391   -0.7431   -1.2362 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3116    0.4034    1.1740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5113    1.2159   -0.3996 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3352   -0.8120   -1.4542 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1438   -1.4938    0.1843 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8126    1.2521   -0.6447 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9916    0.4949    0.9926 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1909   -0.4655   -1.6263 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2993   -1.3227   -0.0006 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3467    1.5514   -0.5983 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1206    0.8647    0.9157 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3481   -0.7867    1.1248 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