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
    2.3761   -0.4778    0.0786 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4814    0.6682   -0.1427 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9343    1.6004   -0.9532 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1711    0.8454    0.4491 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8699   -0.1761    0.1682 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5853   -1.5657    0.5820 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1116    0.2734    0.9620 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2998   -0.1810   -1.2843 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3857   -0.1608    0.4208 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5272   -1.0663   -0.8751 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0125   -1.2142    0.8051 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9264    1.4545   -1.3940 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3635    2.5025   -1.1987 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2911    1.8214    0.1771 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3192    0.9292    1.5681 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0118   -2.1632   -0.1229 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2146   -1.5805    1.6206 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5833   -2.1000    0.6358 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6780    1.0340    0.4074 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8158    0.7054    1.9424 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7730   -0.5745    1.1779 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7791   -1.1490   -1.5636 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0607    0.6212   -1.4926 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4470   -0.0463   -1.9678 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