Monomers

2,4,4-Trimethyl-1-pentene

Identifiers

IUPAC name
2,4,4-trimethylpent-1-ene
InchI
InChI=1S/C8H16/c1-7(2)6-8(3,4)5/h1,6H2,2-5H3
InchI Key
FXNDIJDIPNCZQJ-UHFFFAOYSA-N
SMILES
CC(=C)CC(C)(C)C
Canonical SMILES
CC(=C)CC(C)(C)C
Isomeric SMILES
CC(=C)CC(C)(C)C
Resources
cid=

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
2.9987
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
    2.2986    0.5205   -0.4253 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5095   -0.4468    0.3791 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0614   -0.8711    1.5423 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2085   -0.9470   -0.0404 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9028    0.0248   -0.1809 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1346   -0.8005   -0.6143 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2943    0.6987    1.1086 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6584    1.1123   -1.2186 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9628    0.5179   -1.4778 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2357    1.5375    0.0215 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3734    0.1866   -0.4737 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5229   -1.5767    2.1625 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0319   -0.5157    1.8608 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0747   -1.7929    0.6531 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3042   -1.4784   -1.0394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9567   -0.1293   -0.8615 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4163   -1.3837    0.2878 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8598   -1.5023   -1.4155 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4007    0.0117    1.9538 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3125    1.1441    0.9362 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6399    1.5636    1.3484 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3017    0.6341   -2.1472 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0769    1.8634   -0.8932 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6334    1.6292   -1.4663 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  3
  2  4  1  0
  4  5  1  0
  5  6  1  0
  5  7  1  0
  5  8  1  0
  1  9  1  0
  1 10  1  0
  1 11  1  0
  3 12  1  0
  3 13  1  0
  4 14  1  0
  4 15  1  0
  6 16  1  0
  6 17  1  0
  6 18  1  0
  7 19  1  0
  7 20  1  0
  7 21  1  0
  8 22  1  0
  8 23  1  0
  8 24  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers