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
    2.0996   -0.4403   -1.0418 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5613    0.3803    0.0604 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3250    0.5645    1.1133 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2162    1.0037    0.0386 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9142    0.0120   -0.0791 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1979    0.8448   -0.0812 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8978   -0.7921   -1.3391 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0006   -0.9002    1.1164 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0741   -1.5181   -0.7300 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1671   -0.1506   -1.1772 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6185   -0.3005   -2.0066 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0275    1.1492    1.9769 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3061    0.1210    1.1462 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1605    1.7742   -0.7600 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0153    1.5729    0.9879 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2442    1.4443   -1.0165 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1931    1.5580    0.7790 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0324    0.1433   -0.0576 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2382   -1.6593   -1.3336 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7598   -0.1252   -2.2119 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9394   -1.2121   -1.4587 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2771   -1.7365    1.0512 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0109   -1.3797    1.1279 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8657   -0.3536    2.0717 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