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
   -1.8359   -0.9161    0.8756 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8779   -0.1429   -0.0058 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6445    0.3795   -1.2078 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2138   -1.0944   -0.4556 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0706   -0.3018   -1.2554 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7247    0.5365   -0.3316 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8947    1.4832    0.2104 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2804    1.0142    0.7288 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1181    0.8965   -0.5143 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7740   -0.1228    0.4332 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2337   -1.3837    1.6870 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3237   -1.6729    0.2254 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5739   -0.1985    1.2782 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3949    1.1000   -0.8012 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9650    0.9249   -1.8951 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1938   -0.4217   -1.7193 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1656   -1.9654   -0.9836 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7755   -1.3681    0.4828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0320    1.8546    0.6582 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2382    0.7633    1.8081 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9575    1.4340   -0.9354 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2306   -0.7985    1.1430 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