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
    2.1202    0.2398    1.1825 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6015    0.0178   -0.1903 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3603    0.5092   -1.1592 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3841   -0.6627   -0.5649 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9040   -0.1021   -0.0465 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9864   -1.0252   -0.6068 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2372    1.2556   -0.5938 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0733   -0.2126    1.4341 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7176   -0.5604    1.8680 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2208    0.0778    1.1770 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9504    1.2366    1.5719 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3056    1.0435   -0.9751 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0863    0.4104   -2.2149 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2868   -0.6766   -1.6690 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3697   -1.7594   -0.2834 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6983   -2.0534   -0.2636 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9898   -0.9665   -1.7082 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9672   -0.7494   -0.1693 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2661    1.5102   -0.2796 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5748    2.0587   -0.2486 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2469    1.1775   -1.6953 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6883   -1.1850    1.7661 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6096    0.5966    2.0139 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1616   -0.1807    1.6550 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