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
    2.1424    0.9416    0.2097 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4756   -0.1432   -0.5334 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1756   -1.1898   -0.9155 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0393   -0.0770   -0.8587 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8814    0.0057    0.3045 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6956    1.1938    1.1974 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8553   -1.2311    1.1766 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3036    0.0947   -0.2578 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1468    1.0866   -0.2906 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6200    1.9104    0.1700 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4091    0.6474    1.2522 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2341   -1.2724   -0.6956 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7450   -2.0308   -1.4700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2914   -0.9824   -1.4508 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1937    0.7767   -1.5414 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7182    2.1629    0.6252 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6154    1.2339    1.8553 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1493    1.1195    1.8912 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6814   -2.1542    0.6115 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8199   -1.3259    1.7328 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0667   -1.1334    1.9578 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3560   -0.3724   -1.2711 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6249    1.1485   -0.3541 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0337   -0.4093    0.4089 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