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
    2.2308    0.7578   -0.2587 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4851   -0.4788    0.0502 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1148   -1.6402   -0.2421 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1560   -0.4717    0.6548 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9482    0.1321   -0.1543 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6777    1.5701   -0.4529 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1213   -0.6566   -1.4385 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2532    0.0594    0.6035 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2938    0.9045   -1.3593 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9166    1.6250    0.3191 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3088    0.5333    0.0426 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0979   -1.6786   -0.6733 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6368   -2.6043   -0.0465 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1428   -1.5411    0.8829 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1942   -0.0006    1.6709 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3871    2.0900    0.4909 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6441    2.0663   -0.7944 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0982    1.7588   -1.2057 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2037   -0.8921   -1.6209 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7525   -0.0641   -2.2998 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6089   -1.6359   -1.3394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3218   -0.8543    1.2106 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0649    0.0343   -0.1484 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4066    0.9868    1.2219 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