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
   -1.6558    0.6698   -1.0691 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8619    0.1261    0.0734 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8361   -0.4745    1.0716 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0390   -1.0452   -0.4657 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0445   -0.5210   -1.1783 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8280    0.1616   -0.2230 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2243    1.3300    0.1780 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0001    1.1188    0.7662 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6376   -0.6544    0.6700 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2745    0.1473   -0.3309 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2617    1.5412   -0.8034 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3735   -0.1354   -1.3826 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0405    0.8771   -1.9646 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2860   -0.8614    1.9462 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5328    0.3562    1.3567 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4490   -1.2539    0.6068 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3025   -1.6097    0.4263 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6708   -1.6881   -1.0897 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5456    2.0910    0.8346 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1686    0.7387    1.8163 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8578   -1.3432    1.4638 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2152    0.4289   -0.7443 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