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
    2.7302   -1.0425   -0.3626 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5047   -0.3108    0.1436 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6738    0.5052    1.1554 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2580   -0.6014   -0.5699 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9552    0.1398   -0.1152 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8231    1.6308   -0.2423 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1004   -0.2987   -1.0286 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3596   -0.1657    1.2918 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8782   -1.9525    0.2330 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6286   -0.3811   -0.2803 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6304   -1.2704   -1.4432 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6382    0.6404    1.5952 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8367    1.0419    1.5510 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4205   -0.3355   -1.6475 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0509   -1.6863   -0.4694 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0834    2.1677    0.6982 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1945    1.9576   -0.5492 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5367    1.9814   -1.0207 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7314   -0.4048   -2.0877 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8969    0.4771   -1.0801 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4955   -1.2850   -0.7532 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5179    0.7417    1.8916 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3172   -0.7138    1.2875 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6274   -0.8352    1.8026 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