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
    2.2034    1.0716    0.0218 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5873   -0.2796   -0.0885 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2847   -1.2924    0.4171 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3135   -0.5899   -0.6885 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9108    0.0184   -0.1408 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0948   -0.3737    1.3126 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1035   -0.6200   -0.8756 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0709    1.4810   -0.2523 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9196    1.7381   -0.8234 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9563    1.5237    1.0154 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3146    1.0230   -0.0051 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2516   -1.1671    0.8890 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9385   -2.3388    0.3982 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3987   -0.3123   -1.7874 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1700   -1.6882   -0.7240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1559   -0.2880    1.8919 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3786   -1.4506    1.3074 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9147    0.2376    1.7894 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9761   -0.4849   -1.9742 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1140   -1.7141   -0.6417 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0348   -0.1285   -0.5804 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6342    2.0738    0.5707 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7718    1.8513   -1.2618 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1779    1.7096   -0.1921 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