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
   -2.0522   -0.3888    0.6746 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9065    0.2445   -0.1229 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4504    1.4072   -0.9083 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2707   -0.8103   -0.9694 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0934   -0.7666   -1.0149 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7338   -0.6624    0.1838 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8927   -0.3053    1.2464 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1485    0.7825    0.8207 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1022   -0.0876    0.1714 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8668   -1.4944    0.5580 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0225    0.0868    0.4394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8363   -0.3511    1.7671 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1433   -1.4778    0.4143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1594    2.3891   -0.4553 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5686    1.3994   -0.9104 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0259    1.4203   -1.9353 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6416   -0.6417   -2.0238 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6360   -1.8389   -0.7169 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2649    1.3910    1.6355 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8029    1.4517    0.2113 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9056    0.6035    0.0602 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4322   -2.3511    0.8745 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