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
    2.2060    0.6664    0.1907 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4691   -0.3102   -0.6366 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8816   -0.5883   -1.8525 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2820   -0.9709   -0.1096 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8443   -0.0777    0.2795 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3543    0.7394   -0.8716 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5830    0.8220    1.4333 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0005   -1.0051    0.6904 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3088    0.5796    0.0901 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0117    0.5170    1.2922 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9756    1.7262   -0.1109 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3948   -1.2881   -2.5105 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7640   -0.0894   -2.2270 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5951   -1.5502    0.8027 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1351   -1.7523   -0.7970 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2684    0.2271   -1.8478 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8155    1.7241   -0.8985 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4157    1.0044   -0.6517 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1439    0.2911    2.3191 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0416    1.7538    1.1867 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5925    1.1707    1.8090 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7067   -1.4041    1.6851 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0985   -1.8018   -0.0685 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8887   -0.3838    0.8035 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