Monomers

6,6-Dimethyl-4,8-dioxaspiro[2.5]oct-1-ene

Identifiers

IUPAC name
6,6-dimethyl-4,8-dioxaspiro[2.5]oct-1-ene
InchI
InChI=1S/C8H12O2/c1-7(2)5-9-8(3-4-8)10-6-7/h3-4H,5-6H2,1-2H3
InchI Key
AINMINDCBBSFAO-UHFFFAOYSA-N
SMILES
CC1(C)COC2(OC1)C=C2
Canonical SMILES
CC1(COC2(C=C2)OC1)C
Isomeric SMILES
CC1(COC2(C=C2)OC1)C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H12O2
Heavy Atom Count
10
Molecular Weight
140.182
Exact Molecular Weight
140.0837
Valence Electrons
56
Radical Electrons
0
tPSA
18.46
MolLogP
1.3255
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
1
Aromatic Carbocycles
0
Aliphatic Heterocycles
1
Aromatic Heterocycles
0
Aliphatic Rings
2
Aromatic Rings
0

MOL File


     RDKit          3D

 22 23  0  0  0  0  0  0  0  0999 V2000
   -1.6762   -0.7189   -0.8816 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9137    0.1680    0.1069 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8624    1.1791    0.6810 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2413   -0.6937    1.1042 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1038   -0.7619    1.0726 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7393   -0.5962   -0.1109 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9520   -0.2458   -1.1809 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1690    0.8473   -0.7360 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9934    0.2424   -0.0126 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0946   -1.0848   -0.2735 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6196   -0.2525   -1.1921 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0456   -0.9946   -1.7497 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9125   -1.6954   -0.3696 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3655    0.8565    1.5882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6179    1.4121   -0.1274 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3225    2.1595    0.8229 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5435   -0.3258    2.1298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6689   -1.7388    1.0680 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7617    1.4828   -0.0663 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2511    1.4190   -1.5649 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4232    1.2172    0.1537 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8038   -1.8757   -0.4618 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  6  9  1  0
  9 10  2  0
  8  2  1  0
 10  6  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  3 14  1  0
  3 15  1  0
  3 16  1  0
  4 17  1  0
  4 18  1  0
  8 19  1  0
  8 20  1  0
  9 21  1  0
 10 22  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers