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
    2.0125    0.8690    0.5726 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4259    0.6241   -0.7559 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2077    0.3395   -1.7698 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0281    0.7126   -0.9349 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8622   -0.2460   -0.1702 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7567   -0.1862    1.3136 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3230    0.0845   -0.5167 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6713   -1.6859   -0.6038 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3323    1.4460    1.2111 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9371    1.4991    0.3937 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4216   -0.0520    1.0407 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8221    0.1558   -2.7467 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2734    0.2902   -1.6086 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3582    1.7413   -0.6532 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2673    0.5835   -2.0145 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1902   -0.6120    1.6337 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9318    0.8727    1.6537 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5836   -0.8299    1.7168 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5791    0.9637    0.0907 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9708   -0.7965   -0.3319 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3326    0.3645   -1.5861 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5396   -1.7770   -1.6977 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1662   -2.1232   -0.0223 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5846   -2.2375   -0.2927 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