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
   -1.9807    1.0877   -0.2573 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8691    0.0928    0.1049 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5524   -0.9937    0.9304 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3115   -0.4125   -1.1762 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0046   -0.6874   -1.2128 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8370   -0.0684   -0.3559 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3397    1.0029    0.3386 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1412    0.7573    0.9861 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9364   -0.8954    0.2059 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2758    0.0876   -0.7566 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8506    0.4900   -0.5485 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6430    1.6414   -1.1740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1430    1.8037    0.5477 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1360   -1.6820    0.3139 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8618   -1.5168    1.5973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2876   -0.4483    1.5876 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8734   -1.3588   -1.4335 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5557    0.2767   -2.0375 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3101    0.1957    1.9435 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2626    1.7551    1.3128 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3883   -1.6591    0.8254 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0944    0.5316   -1.3103 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