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
    2.1367    0.7811   -0.6107 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5708   -0.2354    0.3001 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3137   -1.2897    0.5392 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2652   -0.0671    0.9033 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9179    0.0199    0.0080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1246   -1.1738   -0.8622 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8867    1.3084   -0.7692 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1891    0.1225    0.8824 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2538    0.8208   -0.4721 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7842    1.7994   -0.4612 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9952    0.4709   -1.6892 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2912   -1.4265    0.1028 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9268   -2.0515    1.2020 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2676    0.8162    1.6180 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0710   -0.9449    1.5958 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1745   -1.1379   -1.2481 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4232   -1.1942   -1.7184 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0691   -2.0859   -0.2393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5353    2.1025   -0.0465 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2311    1.2991   -1.6394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9411    1.6133   -1.0572 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0132    0.9373    1.5908 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3517   -0.8665    1.3474 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0185    0.3821    0.2002 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