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
   -1.8949    1.1023   -0.3398 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8884    0.0439    0.0264 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5636   -1.0992    0.7506 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2267   -0.4889   -1.1899 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0063   -1.0458   -0.9994 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7747   -0.4416   -0.0236 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0974   -0.3069    1.1902 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1170    0.6602    0.9630 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7239    0.6093   -0.3110 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1835   -0.6767    0.0187 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1724    1.6384    0.6087 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4134    1.8345   -0.9939 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7916    0.7059   -0.8278 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6533   -1.1097    0.5448 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3541   -1.0999    1.8393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1833   -2.0874    0.3626 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2384    0.3082   -1.9738 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9001   -1.2932   -1.6029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3178    0.9379    1.9348 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5883    1.5087    0.4275 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0414    1.5906   -0.5716 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0655   -1.2906    0.1671 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