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
    1.9451   -0.0810    1.3442 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5715   -0.3142   -0.0786 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5104   -0.0395   -0.9744 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2672   -0.8151   -0.5142 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9112    0.0220   -0.1580 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0859    0.2134    1.3233 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9528    1.3506   -0.8471 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1560   -0.7438   -0.6382 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3486   -0.6315    2.0655 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0128   -0.4119    1.5211 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9909    1.0270    1.5630 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5018    0.3330   -0.7360 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3037   -0.1866   -2.0211 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2732   -0.9533   -1.6253 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0630   -1.8618   -0.1332 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0335   -0.7570    1.8798 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3975    0.9801    1.7333 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1167    0.5989    1.5722 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0101    1.9229   -0.7741 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2357    1.2254   -1.9218 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7216    1.9679   -0.3085 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0514   -0.2935   -0.2134 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1366   -0.7573   -1.7473 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9793   -1.7949   -0.3111 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