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
    2.2968    0.1404   -0.4420 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1191   -0.4585   -1.0984 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0902   -0.5468   -2.4134 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0104   -0.9575   -0.3054 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7224    0.0300    0.5417 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0862    0.7168    1.5880 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8398   -0.7330    1.2686 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4302    1.1015   -0.2725 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7257   -0.5389    0.3514 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1650    0.2445   -1.1617 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1375    1.1707   -0.0737 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2679   -0.9713   -2.9832 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9272   -0.1801   -2.9882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7963   -1.4483   -0.9537 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3030   -1.8013    0.3810 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3090    1.7961    1.3355 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4947    0.8121    2.5553 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0358    0.2526    1.8465 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3559   -1.6286    1.7029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6263   -1.0584    0.5532 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2741   -0.0926    2.0498 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4348    2.0819    0.2490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9801    1.2203   -1.2822 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4985    0.8482   -0.4484 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