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
    1.8854    1.4064    0.2203 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5856   -0.0309    0.4165 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2943   -0.6676    1.3192 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5474   -0.7530   -0.3469 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8427   -0.2000   -0.1731 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7541   -1.0827   -1.0374 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3357   -0.3277    1.2366 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0163    1.1972   -0.6683 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0084    1.5271    0.2754 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4974    2.0495    1.0298 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5807    1.7166   -0.7913 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0642   -0.1994    1.9067 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0998   -1.7146    1.4854 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5161   -1.8207   -0.0473 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8141   -0.7556   -1.4285 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2375   -1.8620   -0.4412 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1767   -1.5352   -1.8817 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5592   -0.4825   -1.5076 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4427   -0.1224    1.2112 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9085    0.4033    1.9268 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2327   -1.3704    1.6020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5892    1.2791   -1.7111 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6675    1.9831    0.0024 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1306    1.3624   -0.7719 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