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
    2.8380   -0.7112    0.3723 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5301    0.0436    0.2764 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5470    1.3362    0.5057 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3662   -0.7771   -0.0697 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9384   -0.0703   -0.1687 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9807   -1.1400   -0.5393 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4097    0.5353    1.1154 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9709    0.9399   -1.2862 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8724   -1.2799    1.3307 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9113   -1.3886   -0.5015 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6970   -0.0355    0.3528 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4670    1.8254    0.7518 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6389    1.9022    0.4460 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5247   -1.3355   -1.0238 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2640   -1.5648    0.7212 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7255   -2.0873   -0.0529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0000   -0.8227   -0.1983 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9571   -1.2474   -1.6315 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6496    0.5334    1.9243 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6861    1.5913    0.9173 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3581    0.0700    1.5028 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6905    0.6596   -2.1064 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3387    1.9104   -0.9034 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0487    1.1131   -1.7352 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