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
    2.6685    1.2175   -0.1691 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5197    0.2642   -0.0671 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7776   -1.0074    0.0394 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1757    0.8501   -0.1008 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9689   -0.1182   -0.0420 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9707   -1.0784   -1.1820 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3071    0.6487   -0.0998 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9828   -0.7902    1.3241 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5951    0.6901   -0.5219 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8858    1.5278    0.8944 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3876    2.0571   -0.8007 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0022   -1.7452    0.1169 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8084   -1.3563    0.0523 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0397    1.4151   -1.0641 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0761    1.6449    0.7025 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0645   -0.8709   -1.8065 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8445   -0.8572   -1.8589 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0961   -2.1372   -0.9143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4378    1.2981    0.7669 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2522    1.2496   -1.0336 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1071   -0.1108   -0.2137 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0680   -1.8769    1.2873 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7932   -0.3832    1.9836 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0435   -0.5315    1.8732 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