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
   -2.3279    1.6116   -0.4739 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6074    0.4114    0.3950 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5591   -0.6658    0.2275 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1771   -0.1055    0.6137 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7839   -1.2204    0.4211 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2067   -0.9624    0.7109 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8972    0.0302   -0.1314 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4617    0.5846   -1.2197 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5780    1.3137   -1.2574 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2641    1.9787   -0.9568 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8289    2.4208    0.1036 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6598    0.6525    1.4674 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5779   -0.0486    0.1026 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5300   -1.0846   -0.7976 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8144   -1.5016    0.9104 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2592    0.2262    1.6788 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0032    0.7792   -0.0034 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6956   -1.5734   -0.6365 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4810   -2.1251    1.0278 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7382   -1.9507    0.5253 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4100   -0.7826    1.7954 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9057    0.3295    0.2174 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5143    0.3617   -1.6308 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0862    1.3205   -1.7551 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