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
    2.1818    0.8382   -0.4449 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5397   -0.3530    0.1595 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1721   -1.5130    0.0219 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2781   -0.3502    0.9098 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9368    0.0481    0.1236 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1862   -0.0190    1.0293 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1927   -0.8601   -1.0353 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7976    1.4996   -0.3114 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8761    1.8012   -0.0045 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3074    0.7765   -0.3122 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0490    0.9037   -1.5419 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7311   -2.3946    0.4494 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0921   -1.5811   -0.4959 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4449    0.3595    1.7772 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0725   -1.3244    1.4066 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2406    0.8575    1.6797 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0539   -0.0137    0.3332 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1768   -0.9882    1.5426 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3595   -1.6034   -1.1995 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1077   -1.4838   -0.9085 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2874   -0.2768   -1.9502 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1730    1.6117   -1.2075 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3999    2.1362    0.4926 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8326    1.9292   -0.5136 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